id
stringlengths 1
4
| question
stringclasses 60
values | answer
stringlengths 1
2.6k
| images
images listlengths 1
4
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|---|---|---|---|
1901
|
Identify this molecule by its canonical SMILES.<image>
|
C=C1[C@H](CC(=O)OCCCCCCCCCCCCCCCC)C1(F)F
| |
1902
|
<image>Give the canonical isomeric SMILES for this structure.
|
NC1=NC(=O)[C@@H]2N=CN([C@@H]3C=C[C@@H](CO)O3)C2=N1
| |
1903
|
<image>Give the canonical isomeric SMILES for this structure.
|
Cc1noc([C@@H]2C[C@@H]3CC[C@@H]2N3)n1
| |
1904
|
<image>Determine the canonicalized SMILES for the molecule in the picture.
|
C=CCOc1ccc(OC(=O)CCc2nc3ccccc3o2)cc1
| |
1905
|
Identify this molecule by its canonical SMILES.<image>
|
CC[C@H](C)[C@]1(C2CC2)c2cc(Cl)ccc2NC(=O)N1CC(F)(F)F
| |
1906
|
<image>Determine the canonicalized SMILES for the molecule in the picture.
|
COc1ccc(N2CC[C@@H](NC(=O)c3c(Cl)cncc3Cl)C2)cc1
| |
1907
|
<image>Give the canonical isomeric SMILES for this structure.
|
NCCN(CCO)C(=O)CCn1cnc([N+](=O)[O-])c1
| |
1908
|
<image>From the image, produce the canonical isomeric SMILES string.
|
C#CCNS(=O)(=O)c1cccc(C(=O)N[C@@H](C)C2CCCCCC2)c1
| |
1909
|
<image>Give the canonical isomeric SMILES for this structure.
|
COc1cc([C@H]2NCCc3cnc4c(OC)cccc4c32)ccc1[N+](=O)[O-]
| |
1910
|
Identify this molecule by its canonical SMILES.<image>
|
Cn1ncc([N+](=O)[O-])c1N1C[C@@H](F)[C@@H](C(=O)O)C1
| |
1911
|
Provide the canonical SMILES notation for the displayed molecule.<image>
|
Cc1ccc(O)c([C@H](C)NC[C@H]2CCCCN(Cc3ccccc3)C2)c1
| |
1912
|
Identify this molecule by its canonical SMILES.<image>
|
O=C(N[C@@H](CS(=O)(=O)N1C[C@H](CO)[C@@H](O)[C@@H](O)C1)C(=O)O)OCc1ccccc1
| |
1913
|
<image>From the image, produce the canonical isomeric SMILES string.
|
CN(C)[C@@H]1COC[C@@H]1NC(=O)[C@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C
| |
1914
|
<image>Determine the canonicalized SMILES for the molecule in the picture.
|
C=C(C)CCC(=O)N(C)C[C@@H](O)CNC(=O)C(=O)NCC1CC1
| |
1915
|
<image>Give the canonical isomeric SMILES for this structure.
|
N#C[C@@H](c1ccccc1)N1CCc2ccccc2[C@H]1c1ccnn1CC1CC1
| |
1916
|
Return the canonical SMILES (including stereochemistry) for this 2D molecule image.<image>
|
FC(F)Oc1ccc(-c2nc3c(C(F)(F)F)cc(C(F)(F)F)cc3[nH]2)cc1
| |
1917
|
Please provide the canonical SMILES string for this molecule.<image>
|
CC(C)(C)OC(=O)N(Cc1cccs1)[C@@]1(C#N)CC[C@@]2(CCCOC2)C1
| |
1918
|
Identify this molecule by its canonical SMILES.<image>
|
CC(C)(C)OC(=O)NCc1cc(F)cc(NCc2cc(Cl)sc2Cl)c1
| |
1919
|
Provide the canonical SMILES notation for the displayed molecule.<image>
|
CC(=O)O[C@]1(C)[C@H](O)C2=C(c3c(O)c4c(c(O)c3=C2NN)C(=O)C=CC=4)[C@@H](O)[C@@H]1O
| |
1920
|
Return the canonical SMILES (including stereochemistry) for this 2D molecule image.<image>
|
Cc1ccc(NC(=O)C(C)(C)C2CCCCC2)c(N)c1[N+](=O)[O-]
| |
1921
|
What is the canonical SMILES representation of the molecule depicted above?<image>
|
C#CCCN(CC(C)(C)C)C[C@](C)(O)c1ccccc1
| |
1922
|
<image>Determine the canonicalized SMILES for the molecule in the picture.
|
C=C1C[C@@]2(C)[C@@H]3CC[C@@]4(C)[C@@H](OC(C)=O)CC[C@@H]4[C@@H]3CC[C@H]2OC1=O
| |
1923
|
<image>From the image, produce the canonical isomeric SMILES string.
|
CC1=C(N2CC2)C(=O)c2nc3n(c2C1=O)CC[C@@H]3NC(=O)[C@@H](N)Cc1ccccc1
| |
1924
|
Return the canonical SMILES (including stereochemistry) for this 2D molecule image.<image>
|
CCNC(=O)[C@H]1C[C@H](n2cnc3c(N)nc(C#Cc4nccs4)nc32)[C@H](OC)[C@@H]1OC
| |
1925
|
Identify this molecule by its canonical SMILES.<image>
|
CCOCc1noc([C@H]2CN=CNC2)n1
| |
1926
|
<image>Write the canonical SMILES of this molecule
|
C=C(C)C[C@H](NC(C)=O)C(=O)Oc1ccc(OCC(C)C)cc1
| |
1927
|
Please provide the canonical SMILES string for this molecule.<image>
|
CCCN(C[C@@H](C)O)C(=O)CCOC1CCN(C(=O)OC(C)(C)C)CC1
| |
1928
|
Identify this molecule by its canonical SMILES.<image>
|
COc1cccc2nc([C@@H](O)[C@H](O)C(=O)Nc3ccc([N+](=O)[O-])cc3)[nH]c12
| |
1929
|
Identify this molecule by its canonical SMILES.<image>
|
C#CCCCCC(=O)N1CC(N(C)C(=O)c2coc(C(C)(C)C)n2)C1
| |
1930
|
Return the canonical SMILES (including stereochemistry) for this 2D molecule image.<image>
|
Cc1c(Cl)ccc2nc(S)n(CC[C@H](C)C3CC3)c12
| |
1931
|
Please provide the canonical SMILES string for this molecule.<image>
|
C[C@H](N)C[C@@H](C)Nc1ccsc1[N+](=O)[O-]
| |
1932
|
<image>Write the canonical SMILES of this molecule
|
C[C@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1
| |
1933
|
<image>Determine the canonicalized SMILES for the molecule in the picture.
|
Cc1[nH]c2cccc([N+](=O)[O-])c2c1C(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]
| |
1934
|
Canonical SMILES, please: <image>
|
C=C(C)CN[C@H]1C[C@@H](NC(=O)CCn2cnnn2)C1
| |
1935
|
What is the canonical SMILES representation of the molecule depicted above?<image>
|
Cc1ccc(N2C(=O)/C(=C/c3ccc(C(F)(F)F)cc3)SC2=S)cc1Cl
| |
1936
|
<image>Give the canonical isomeric SMILES for this structure.
|
COc1ccc2c3c(c4cc(OC)c(O)cc4c2c1)CN1CCC[C@H]1[C@H]3O
| |
1937
|
Canonical SMILES, please: <image>
|
CCCN[C@H](CC(C)(C)F)c1ccc(-c2cccs2)s1
| |
1938
|
Return the canonical SMILES (including stereochemistry) for this 2D molecule image.<image>
|
CCCCCCCCCC(=O)CC(=O)NCc1ccc(OC)cc1
| |
1939
|
<image>Give the canonical isomeric SMILES for this structure.
|
CC(=O)O[C@@H]1[C@H](C)[C@@H]2C=CC(=O)[C@]2(C)C[C@@H]2[C@@H]1OC(=O)[C@]2(O)CO
| |
1940
|
Provide the canonical SMILES notation for the displayed molecule.<image>
|
CN(C)Nc1nc(N)ncc1[N+](=O)[O-]
| |
1941
|
Identify this molecule by its canonical SMILES.<image>
|
C#CC(C)(C)CNc1ccc(OC(F)F)cc1
| |
1942
|
<image>Give the canonical isomeric SMILES for this structure.
|
COCc1ccccc1CN1CC[C@@]1(C)COC
| |
1943
|
Return the canonical SMILES (including stereochemistry) for this 2D molecule image.<image>
|
CC(C)c1c(O)c(O)cc2c1CC[C@H]1C(C)(C)CCC[C@]21C
| |
1944
|
Identify this molecule by its canonical SMILES.<image>
|
CC[C@@H](CCNC(=O)OC(C)(C)C)C(=O)NCC1(S(N)(=O)=O)CC1
| |
1945
|
<image>Give the canonical isomeric SMILES for this structure.
|
Cc1cc(NS(C)(=O)=O)cc(C)c1Nc1c2ccccc2nc2ccccc12
| |
1946
|
Canonical SMILES, please: <image>
|
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1
| |
1947
|
Return the canonical SMILES (including stereochemistry) for this 2D molecule image.<image>
|
COc1c(C(=O)N2CCCC[C@@H]2Cc2ccccc2)[nH]c2ccccc12
| |
1948
|
<image>Determine the canonicalized SMILES for the molecule in the picture.
|
C[C@@H]1C(=O)N(C)CN1C(=O)C(=O)N1CCN(Cc2ccc(C#N)cc2)CC1
| |
1949
|
Return the canonical SMILES (including stereochemistry) for this 2D molecule image.<image>
|
N#Cc1ccc2ccoc2c1N1CCNCC1
| |
1950
|
<image>From the image, produce the canonical isomeric SMILES string.
|
CC[C@]1(c2nc(CN)no2)CCCO1
| |
1951
|
Return the canonical SMILES (including stereochemistry) for this 2D molecule image.<image>
|
CC(C)(C)OC(=O)N(C1CCC1)[C@@H](C#N)[C@@H]1[C@@H]2CCCCC[C@@H]21
| |
1952
|
Canonical SMILES, please: <image>
|
N=c1[nH]c(-n2cccn2)ncc1[N+](=O)[O-]
| |
1953
|
<image>Give the canonical isomeric SMILES for this structure.
|
CC(=O)OC/C(=C\c1ccccc1)C(=O)c1ccccc1
| |
1954
|
Provide the canonical SMILES notation for the displayed molecule.<image>
|
C#CC(CO)(CO)N[C@H]1[C@H](C)C[C@@H]1C
| |
1955
|
Provide the canonical SMILES notation for the displayed molecule.<image>
|
C[C@@H]1[C@H](O)[C@@]2(O)OC[C@@]34[C@H](C[C@@H]5C=CC(=O)[C@H](O)[C@]5(C)[C@H]23)OC(=O)[C@@H](O)[C@@]14O
| |
1956
|
Canonical SMILES, please: <image>
|
CC(=O)OC[C@H]1O[C@@H](c2c(O)cc3oc(-c4ccc(O)c(O)c4)cc(=O)c3c2O)[C@H](O)[C@@H](O)[C@@H]1O
| |
1957
|
<image>From the image, produce the canonical isomeric SMILES string.
|
CC1(C)C[C@H](NC(=O)NCC[C@@H]2CCCS2)c2cc(F)ccc2O1
| |
1958
|
Identify this molecule by its canonical SMILES.<image>
|
C[C@@H]1C(CC2CC(=C3CCC3)C2)[C@H]1C
| |
1959
|
<image>Give the canonical isomeric SMILES for this structure.
|
CCOC(=O)c1sc(-c2cccc(C(C)C)c2)cc1[N+](=O)[O-]
| |
1960
|
Canonical SMILES, please: <image>
|
C[C@@H](O)CN1C(=O)C(=Cc2ccc3c(c2)OCO3)SC1=S
| |
1961
|
What is the canonical SMILES representation of the molecule depicted above?<image>
|
CN(C)S(=O)(=O)CCn1c(-c2cnn(C)c2)nnc1N1CC[C@H]2CCNC(=O)[C@H]2C1
| |
1962
|
<image>From the image, produce the canonical isomeric SMILES string.
|
CN(C)CCN(C(=O)c1cc(O)c(O)c(O)c1)[C@@H]1CCS(=O)(=O)C1
| |
1963
|
Please provide the canonical SMILES string for this molecule.<image>
|
C[C@](O)(c1ccns1)c1ccc(Br)c(F)c1F
| |
1964
|
<image>Give the canonical isomeric SMILES for this structure.
|
CC(C)CC(=O)Nc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1c[nH]c3ccccc13)N2
| |
1965
|
<image>Write the canonical SMILES of this molecule
|
C#CCN(c1nnc([C@@H]2CCS(=O)(=O)C2)n1CC(=O)NCC=C)[C@H]1CCS(=O)(=O)C1
| |
1966
|
Identify this molecule by its canonical SMILES.<image>
|
CC[C@H](O)[C@@H]1C[C@@H]1[C@@H]1C[C@@H]2O[C@H]2[C@H]1C=CCCCCC(=O)OC
| |
1967
|
<image>Give the canonical isomeric SMILES for this structure.
|
CN(C)C(=O)CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@@H]2C1
| |
1968
|
Canonical SMILES, please: <image>
|
NC(=O)C[C@H](NC(=O)/C=C/c1ccccc1[N+](=O)[O-])C(=O)NCCc1ccc(S(N)(=O)=O)cc1
| |
1969
|
Identify this molecule by its canonical SMILES.<image>
|
CS(=O)(=O)C1CCN(C(=O)c2ccc(F)c(S(=O)(=O)Cc3ncon3)c2)CC1
| |
1970
|
Provide the canonical SMILES notation for the displayed molecule.<image>
|
Cc1cc([N+](=O)[O-])cc(C(=O)N2CCCN(C(=O)Cc3cccc(F)c3)CC2)n1
| |
1971
|
Please provide the canonical SMILES string for this molecule.<image>
|
Cc1ccc([C@@]2(CCCC(=O)O)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1
| |
1972
|
Provide the canonical SMILES notation for the displayed molecule.<image>
|
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2C(=O)N1CC[C@](O)(C(N)=O)C1
| |
1973
|
Return the canonical SMILES (including stereochemistry) for this 2D molecule image.<image>
|
C=CCC(C)(C)C(=O)N(C)C[C@H]1CCN1C(=O)CCC(C)(C)C
| |
1974
|
Return the canonical SMILES (including stereochemistry) for this 2D molecule image.<image>
|
[N-]=[N+]=NCc1cn2cc(Cl)cnc2n1
| |
1975
|
<image>Give the canonical isomeric SMILES for this structure.
|
CC(/C=C(\O)c1cccnc1)=N\c1cccc(Cl)c1C
| |
1976
|
Return the canonical SMILES (including stereochemistry) for this 2D molecule image.<image>
|
C=C1c2cccc(O)c2C(=O)C2=C(O)[C@]3(O)C(=O)[C@H](C(N)=O)C(=O)[C@H](N(C)C)[C@@H]3[C@H](O)[C@@H]12
| |
1977
|
What is the canonical SMILES representation of the molecule depicted above?<image>
|
C=C(CO)C(=O)O[C@H]1C[C@@](C)(O)[C@]2(OC)CC[C@](C)(/C=C3/OC(=O)C(COC(C)=O)=C31)O2
| |
1978
|
<image>Determine the canonicalized SMILES for the molecule in the picture.
|
CCCCN(CC)c1cc(N2CCc3ccc([N+](=O)[O-])cc32)nc(-c2ccccc2)n1
| |
1979
|
Please provide the canonical SMILES string for this molecule.<image>
|
C=CCC(CC=C)[C@H](CCC[C@H](NC(=O)OC(C)(C)C)C(C)C)NCC
| |
1980
|
Please provide the canonical SMILES string for this molecule.<image>
|
CC(C)(CC(F)F)C[C@H](O)c1cccc(Cl)c1
| |
1981
|
Provide the canonical SMILES notation for the displayed molecule.<image>
|
CS[C@H]1CCC[C@@H](Nc2ncc([N+](=O)[O-])c3ccccc23)C1
| |
1982
|
<image>Give the canonical isomeric SMILES for this structure.
|
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)N1CCC(n2cc(CCO)nn2)CC1
| |
1983
|
Please provide the canonical SMILES string for this molecule.<image>
|
O=C1NCC[C@H]1C(=O)NCCN(CCN1C(=O)CCC1=O)C1CC1
| |
1984
|
Provide the canonical SMILES notation for the displayed molecule.<image>
|
CC[C@H](C)C(NC(=O)[C@H](N)CS)=C(O)O
| |
1985
|
<image>Write the canonical SMILES of this molecule
|
COC(=O)/C=C1/C(=O)N2[C@@H](C(=O)O)[C@](C)(COC(C)=O)S(=O)(=O)[C@H]12
| |
1986
|
What is the canonical SMILES representation of the molecule depicted above?<image>
|
Cc1ccn2c(/N=N\c3cc(Cl)ccc3O)c(C(C)(C)C)nc2c1
| |
1987
|
<image>From the image, produce the canonical isomeric SMILES string.
|
COC(=O)c1cccc2c1CCN2C(=O)c1cccc(O)c1O
| |
1988
|
Please provide the canonical SMILES string for this molecule.<image>
|
CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@]1(C)CC=C(C)CC1
| |
1989
|
<image>From the image, produce the canonical isomeric SMILES string.
|
COc1ccc([C@@]2(CC(=O)C(F)(F)F)c3c(F)cccc3C[C@H]3CCCN32)cc1
| |
1990
|
Canonical SMILES, please: <image>
|
CC[C@@H](Oc1ccccc1F)c1nc2cc(C(F)(F)F)ncc2[nH]1
| |
1991
|
Please provide the canonical SMILES string for this molecule.<image>
|
C[C@@H](N)Cc1cc(Cl)ccc1N1CC[C@@](C)(C(F)F)C1
| |
1992
|
Canonical SMILES, please: <image>
|
C[C@H](Cc1cccs1)Nc1cc(N)c([N+](=O)[O-])cc1Cl
| |
1993
|
Canonical SMILES, please: <image>
|
Nc1ccc(N2CCC[C@](O)(c3ccc(Cl)cc3)C2)c([N+](=O)[O-])c1
| |
1994
|
<image>Give the canonical isomeric SMILES for this structure.
|
NNc1ccc([N+](=O)[O-])c(N(CCO)CCO)n1
| |
1995
|
Identify this molecule by its canonical SMILES.<image>
|
CS(=O)(=O)N[C@H]1CCN(CN2Cc3cc(Br)c([N+](=O)[O-])cc3C2=O)C1
| |
1996
|
Please provide the canonical SMILES string for this molecule.<image>
|
COc1cc2c3c(c1)OC1(CCC(Cc4ccccc4)CC1)[C@@H](C2)C3=O
| |
1997
|
Identify this molecule by its canonical SMILES.<image>
|
CNC[C@@H]1Oc2ncc(C#Cc3cccc(OC)c3)cc2C(=O)N([C@@H](C)CO)C[C@@H]1C
| |
1998
|
Canonical SMILES, please: <image>
|
CCn1cc([N+](=O)[O-])c(C(=O)OCC(=O)N[C@@H](C)[C@@H]2C[C@H]3CC[C@H]2C3)n1
| |
1999
|
<image>Determine the canonicalized SMILES for the molecule in the picture.
|
CCc1ccc(C(=O)C/C=N/Cc2ccc(F)cc2)cc1
| |
2000
|
What is the canonical SMILES representation of the molecule depicted above?<image>
|
C[C@H](N)C(=O)N[C@H](CNC(=O)C=CC(N)=O)C(=O)O
|
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