Product OPENEYE NAME: (E)-2-cyano-1-methoxy-2-(1-methyltetrazol-5-yl)ethenolate
CAS Name: (E)-2-cyano-1-methoxy-2-(1-methyl-5-tetrazolyl)ethenolate
IUPAC NAME: (E)-2-cyano-1-methoxy-2-(1-methyltetrazol-5-yl)ethenolate
SYSTEMATIC NAME: (E)-2-cyano-1-methoxy-2-(1-methyl-1,2,3,4-tetrazol-5-yl)ethenolate
MOLECULAR FORMULA: C6H6N5O2-
MOLECULAR WEIGHT: 180.14414
SMILES: CN1C(=NN=N1)/C(=C(\[O-])/OC)/C#N
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Product OPENEYE NAME: methyl 2-cyano-2-(1-methyl-2H-tetrazol-5-ylidene)acetate
CAS Name: 2-cyano-2-(1-methyl-2H-tetrazol-5-ylidene)acetic acid methyl ester
IUPAC NAME: methyl 2-cyano-2-(1-methyl-2H-tetrazol-5-ylidene)acetate
SYSTEMATIC NAME: methyl 2-cyano-2-(1-methyl-2H-1,2,3,4-tetrazol-5-ylidene)ethanoate
MOLECULAR FORMULA: C6H7N5O2
MOLECULAR WEIGHT: 181.15208
SMILES: CN1C(=C(C#N)C(=O)OC)N=NN1
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Product OPENEYE NAME: methyl (E)-3-azido-2-cyano-3-(morpholinoamino)prop-2-enoate
CAS Name: (E)-3-azido-2-cyano-3-(4-morpholinylamino)-2-propenoic acid methyl ester
IUPAC NAME: methyl (E)-3-azido-2-cyano-3-(morpholin-4-ylamino)prop-2-enoate
SYSTEMATIC NAME: methyl (E)-3-azido-2-cyano-3-(morpholin-4-ylamino)prop-2-enoate
MOLECULAR FORMULA: C9H12N6O3
MOLECULAR WEIGHT: 252.22998
SMILES: COC(=O)/C(=C(\NN1CCOCC1)/N=[N+]=[N-])/C#N
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Product OPENEYE NAME: (E)-2-cyano-1-methoxy-2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)ethenolate
CAS Name: (E)-2-cyano-1-methoxy-2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)ethenolate
IUPAC NAME: (E)-2-cyano-1-methoxy-2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)ethenolate
SYSTEMATIC NAME: (E)-2-cyano-1-methoxy-2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)ethenolate
MOLECULAR FORMULA: C5H3N5O2-2
MOLECULAR WEIGHT: 165.10962
SMILES: CO/C(=C(\C#N)/C1=NN=N[N-]1)/[O-]
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Product OPENEYE NAME: (E)-2-cyano-1-ethoxy-2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)ethenolate
CAS Name: (E)-2-cyano-1-ethoxy-2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)ethenolate
IUPAC NAME: (E)-2-cyano-1-ethoxy-2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)ethenolate
SYSTEMATIC NAME: (E)-2-cyano-1-ethoxy-2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)ethenolate
MOLECULAR FORMULA: C6H5N5O2-2
MOLECULAR WEIGHT: 179.1362
SMILES: CCO/C(=C(\C#N)/C1=NN=N[N-]1)/[O-]
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Product OPENEYE NAME: ethyl 2-cyano-2-(1,2-dihydrotetrazol-5-ylidene)acetate
CAS Name: 2-cyano-2-(1,2-dihydrotetrazol-5-ylidene)acetic acid ethyl ester
IUPAC NAME: ethyl 2-cyano-2-(1,2-dihydrotetrazol-5-ylidene)acetate
SYSTEMATIC NAME: ethyl 2-cyano-2-(1,2-dihydro-1,2,3,4-tetrazol-5-ylidene)ethanoate
MOLECULAR FORMULA: C6H7N5O2
MOLECULAR WEIGHT: 181.15208
SMILES: CCOC(=O)C(=C1NNN=N1)C#N
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Product OPENEYE NAME: methyl (Z)-2-cyano-3-methoxy-prop-2-enoate
CAS Name: (Z)-2-cyano-3-methoxy-2-propenoic acid methyl ester
IUPAC NAME: methyl (Z)-2-cyano-3-methoxyprop-2-enoate
SYSTEMATIC NAME: methyl (Z)-2-cyano-3-methoxy-prop-2-enoate
MOLECULAR FORMULA: C6H7NO3
MOLECULAR WEIGHT: 141.12468
SMILES: CO/C=C(/C#N)\C(=O)OC
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Product OPENEYE NAME: (Z)-3-hydroxy-3-methoxy-2-[(E)-(3-oxoindolin-2-ylidene)methyl]prop-2-enenitrile
CAS Name: (Z)-3-hydroxy-3-methoxy-2-[(E)-(3-oxo-1H-indol-2-ylidene)methyl]-2-propenenitrile
IUPAC NAME: (Z)-3-hydroxy-3-methoxy-2-[(E)-(3-oxo-1H-indol-2-ylidene)methyl]prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-methoxy-3-oxidanyl-2-[(E)-(3-oxidanylidene-1H-indol-2-ylidene)methyl]prop-2-enenitrile
MOLECULAR FORMULA: C13H10N2O3
MOLECULAR WEIGHT: 242.2301
SMILES: CO/C(=C(/C=C/1\C(=O)C2=CC=CC=C2N1)\C#N)/O
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Product OPENEYE NAME: (Z)-3-hydroxy-3-methoxy-2-[(E)-(5-methoxy-3-oxo-indolin-2-ylidene)methyl]prop-2-enenitrile
CAS Name: (Z)-3-hydroxy-3-methoxy-2-[(E)-(5-methoxy-3-oxo-1H-indol-2-ylidene)methyl]-2-propenenitrile
IUPAC NAME: (Z)-3-hydroxy-3-methoxy-2-[(E)-(5-methoxy-3-oxo-1H-indol-2-ylidene)methyl]prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-methoxy-2-[(E)-(5-methoxy-3-oxidanylidene-1H-indol-2-ylidene)methyl]-3-oxidanyl-prop-2-enenitrile
MOLECULAR FORMULA: C14H12N2O4
MOLECULAR WEIGHT: 272.25608
SMILES: COC1=CC2=C(C=C1)N/C(=C/C(=C(\O)/OC)/C#N)/C2=O
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Product OPENEYE NAME: methyl (Z)-2-[(E)-(1-acetyl-3-oxo-indolin-2-ylidene)methyl]-3-hydroxy-3-methoxy-prop-2-enoate
CAS Name: (Z)-2-[(E)-(1-acetyl-3-oxo-2-indolylidene)methyl]-3-hydroxy-3-methoxy-2-propenoic acid methyl ester
IUPAC NAME: methyl (Z)-2-[(E)-(1-acetyl-3-oxoindol-2-ylidene)methyl]-3-hydroxy-3-methoxyprop-2-enoate
SYSTEMATIC NAME: methyl (Z)-2-[(E)-(1-ethanoyl-3-oxidanylidene-indol-2-ylidene)methyl]-3-methoxy-3-oxidanyl-prop-2-enoate
MOLECULAR FORMULA: C16H15NO6
MOLECULAR WEIGHT: 317.2934
SMILES: CC(=O)N\1C2=CC=CC=C2C(=O)/C1=C\C(=C(/O)\OC)\C(=O)OC
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Product OPENEYE NAME: methyl (E)-2-cyano-3-[5-methoxy-3-(p-tolylsulfonyloxy)-1H-indol-2-yl]prop-2-enoate
CAS Name: (E)-2-cyano-3-[5-methoxy-3-(4-methylphenyl)sulfonyloxy-1H-indol-2-yl]-2-propenoic acid methyl ester
IUPAC NAME: methyl (E)-2-cyano-3-[5-methoxy-3-(4-methylphenyl)sulfonyloxy-1H-indol-2-yl]prop-2-enoate
SYSTEMATIC NAME: methyl (E)-2-cyano-3-[5-methoxy-3-(4-methylphenyl)sulfonyloxy-1H-indol-2-yl]prop-2-enoate
MOLECULAR FORMULA: C21H18N2O6S
MOLECULAR WEIGHT: 426.44242
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OC2=C(NC3=C2C=C(C=C3)OC)/C=C(\C#N)/C(=O)OC
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Product OPENEYE NAME: (Z)-3-hydroxy-3-methoxy-2-[(E)-(3-oxobenzofuran-2-ylidene)methyl]prop-2-enenitrile
CAS Name: (Z)-3-hydroxy-3-methoxy-2-[(E)-(3-oxo-2-benzofuranylidene)methyl]-2-propenenitrile
IUPAC NAME: (Z)-3-hydroxy-3-methoxy-2-[(E)-(3-oxo-1-benzofuran-2-ylidene)methyl]prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-methoxy-3-oxidanyl-2-[(E)-(3-oxidanylidene-1-benzofuran-2-ylidene)methyl]prop-2-enenitrile
MOLECULAR FORMULA: C13H9NO4
MOLECULAR WEIGHT: 243.21486
SMILES: CO/C(=C(/C=C/1\C(=O)C2=CC=CC=C2O1)\C#N)/O
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Product OPENEYE NAME: (Z)-3-ethoxy-3-hydroxy-2-[(E)-(3-oxobenzofuran-2-ylidene)methyl]prop-2-enenitrile
CAS Name: (Z)-3-ethoxy-3-hydroxy-2-[(E)-(3-oxo-2-benzofuranylidene)methyl]-2-propenenitrile
IUPAC NAME: (Z)-3-ethoxy-3-hydroxy-2-[(E)-(3-oxo-1-benzofuran-2-ylidene)methyl]prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-ethoxy-3-oxidanyl-2-[(E)-(3-oxidanylidene-1-benzofuran-2-ylidene)methyl]prop-2-enenitrile
MOLECULAR FORMULA: C14H11NO4
MOLECULAR WEIGHT: 257.24144
SMILES: CCO/C(=C(/C=C/1\C(=O)C2=CC=CC=C2O1)\C#N)/O
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Product OPENEYE NAME: (Z)-2-[(E)-(5-chloro-3-oxo-benzofuran-2-ylidene)methyl]-3-hydroxy-3-methoxy-prop-2-enenitrile
CAS Name: (Z)-2-[(E)-(5-chloro-3-oxo-2-benzofuranylidene)methyl]-3-hydroxy-3-methoxy-2-propenenitrile
IUPAC NAME: (Z)-2-[(E)-(5-chloro-3-oxo-1-benzofuran-2-ylidene)methyl]-3-hydroxy-3-methoxyprop-2-enenitrile
SYSTEMATIC NAME: (Z)-2-[(E)-(5-chloranyl-3-oxidanylidene-1-benzofuran-2-ylidene)methyl]-3-methoxy-3-oxidanyl-prop-2-enenitrile
MOLECULAR FORMULA: C13H8ClNO4
MOLECULAR WEIGHT: 277.65992
SMILES: CO/C(=C(/C=C/1\C(=O)C2=C(O1)C=CC(=C2)Cl)\C#N)/O
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Product OPENEYE NAME: ethyl (E)-3-ethoxy-3-hydroxy-2-[(Z)-(3-oxobenzofuran-2-ylidene)methyl]prop-2-enoate
CAS Name: (E)-3-ethoxy-3-hydroxy-2-[(Z)-(3-oxo-2-benzofuranylidene)methyl]-2-propenoic acid ethyl ester
IUPAC NAME: ethyl (E)-3-ethoxy-3-hydroxy-2-[(Z)-(3-oxo-1-benzofuran-2-ylidene)methyl]prop-2-enoate
SYSTEMATIC NAME: ethyl (E)-3-ethoxy-3-oxidanyl-2-[(Z)-(3-oxidanylidene-1-benzofuran-2-ylidene)methyl]prop-2-enoate
MOLECULAR FORMULA: C16H16O6
MOLECULAR WEIGHT: 304.29464
SMILES: CCO/C(=C(\C=C/1\C(=O)C2=CC=CC=C2O1)/C(=O)OCC)/O
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Product OPENEYE NAME: dimethyl 2-[(E)-(3-oxobenzofuran-2-ylidene)methyl]propanedioate
CAS Name: 2-[(E)-(3-oxo-2-benzofuranylidene)methyl]propanedioic acid dimethyl ester
IUPAC NAME: dimethyl 2-[(E)-(3-oxo-1-benzofuran-2-ylidene)methyl]propanedioate
SYSTEMATIC NAME: dimethyl 2-[(E)-(3-oxidanylidene-1-benzofuran-2-ylidene)methyl]propanedioate
MOLECULAR FORMULA: C14H12O6
MOLECULAR WEIGHT: 276.24148
SMILES: COC(=O)C(/C=C/1\C(=O)C2=CC=CC=C2O1)C(=O)OC
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Product OPENEYE NAME: diethyl 2-[(E)-(3-oxobenzofuran-2-ylidene)methyl]propanedioate
CAS Name: 2-[(E)-(3-oxo-2-benzofuranylidene)methyl]propanedioic acid diethyl ester
IUPAC NAME: diethyl 2-[(E)-(3-oxo-1-benzofuran-2-ylidene)methyl]propanedioate
SYSTEMATIC NAME: diethyl 2-[(E)-(3-oxidanylidene-1-benzofuran-2-ylidene)methyl]propanedioate
MOLECULAR FORMULA: C16H16O6
MOLECULAR WEIGHT: 304.29464
SMILES: CCOC(=O)C(/C=C/1\C(=O)C2=CC=CC=C2O1)C(=O)OCC
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Product OPENEYE NAME: (2R,3S)-3-(3,4-dimethoxyphenyl)-2-hydroxy-7,8-dimethoxy-chroman-4-one
CAS Name: (2R,3S)-3-(3,4-dimethoxyphenyl)-2-hydroxy-7,8-dimethoxy-3,4-dihydro-2H-1-benzopyran-4-one
IUPAC NAME: (2R,3S)-3-(3,4-dimethoxyphenyl)-2-hydroxy-7,8-dimethoxy-2,3-dihydrochromen-4-one
SYSTEMATIC NAME: (2R,3S)-3-(3,4-dimethoxyphenyl)-7,8-dimethoxy-2-oxidanyl-2,3-dihydrochromen-4-one
MOLECULAR FORMULA: C19H20O7
MOLECULAR WEIGHT: 360.3579
SMILES: COC1=C(C=C(C=C1)[C@H]2[C@@H](OC3=C(C2=O)C=CC(=C3OC)OC)O)OC
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Product OPENEYE NAME: (2R,3R)-3-(3,4-dimethoxyphenyl)-2-hydroxy-7,8-dimethoxy-chroman-4-one
CAS Name: (2R,3R)-3-(3,4-dimethoxyphenyl)-2-hydroxy-7,8-dimethoxy-3,4-dihydro-2H-1-benzopyran-4-one
IUPAC NAME: (2R,3R)-3-(3,4-dimethoxyphenyl)-2-hydroxy-7,8-dimethoxy-2,3-dihydrochromen-4-one
SYSTEMATIC NAME: (2R,3R)-3-(3,4-dimethoxyphenyl)-7,8-dimethoxy-2-oxidanyl-2,3-dihydrochromen-4-one
MOLECULAR FORMULA: C19H20O7
MOLECULAR WEIGHT: 360.3579
SMILES: COC1=C(C=C(C=C1)[C@@H]2[C@@H](OC3=C(C2=O)C=CC(=C3OC)OC)O)OC
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Product OPENEYE NAME: [(6R,6aR,10aS)-11-oxo-6a,7,8,9,10,10a-hexahydro-6H-benzo[c][1]benzothiepin-6-yl] acetate
CAS Name: acetic acid [(6R,6aR,10aS)-11-oxo-6a,7,8,9,10,10a-hexahydro-6H-benzo[c][1]benzothiepin-6-yl] ester
IUPAC NAME: [(6R,6aR,10aS)-11-oxo-6a,7,8,9,10,10a-hexahydro-6H-benzo[c][1]benzothiepin-6-yl] acetate
SYSTEMATIC NAME: [(6R,6aR,10aS)-11-oxidanylidene-6a,7,8,9,10,10a-hexahydro-6H-benzo[c][1]benzothiepin-6-yl] ethanoate
MOLECULAR FORMULA: C16H18O3S
MOLECULAR WEIGHT: 290.37732
SMILES: CC(=O)O[C@H]1[C@@H]2CCCC[C@@H]2C(=O)C3=CC=CC=C3S1
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Product OPENEYE NAME: 2-(2-thienylsulfanylmethyl)furan-3-carbonyl azide
CAS Name: azido-[2-[(thiophen-2-ylthio)methyl]-3-furanyl]methanone
IUPAC NAME: 2-(thiophen-2-ylsulfanylmethyl)furan-3-carbonyl azide
SYSTEMATIC NAME: azido-[2-(thiophen-2-ylsulfanylmethyl)furan-3-yl]methanone
MOLECULAR FORMULA: C10H7N3O2S2
MOLECULAR WEIGHT: 265.31148
SMILES: C1=CSC(=C1)SCC2=C(C=CO2)C(=O)N=[N+]=[N-]
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