Product OPENEYE NAME: 6-methyl-N-(3-morpholinopropyl)-4-oxo-furo[3,2-c]pyran-3-carboxamide
CAS Name: 6-methyl-N-[3-(4-morpholinyl)propyl]-4-oxo-3-furo[3,2-c]pyrancarboxamide
IUPAC NAME: 6-methyl-N-(3-morpholin-4-ylpropyl)-4-oxofuro[3,2-c]pyran-3-carboxamide
SYSTEMATIC NAME: 6-methyl-N-(3-morpholin-4-ylpropyl)-4-oxidanylidene-furo[3,2-c]pyran-3-carboxamide
MOLECULAR FORMULA: C16H20N2O5
MOLECULAR WEIGHT: 320.3404
SMILES: CC1=CC2=C(C(=CO2)C(=O)NCCCN3CCOCC3)C(=O)O1
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Product OPENEYE NAME: dimethyl 2-phenacylfuran-3,4-dicarboxylate
CAS Name: 2-phenacylfuran-3,4-dicarboxylic acid dimethyl ester
IUPAC NAME: dimethyl 2-phenacylfuran-3,4-dicarboxylate
SYSTEMATIC NAME: dimethyl 2-phenacylfuran-3,4-dicarboxylate
MOLECULAR FORMULA: C16H14O6
MOLECULAR WEIGHT: 302.27876
SMILES: COC(=O)C1=COC(=C1C(=O)OC)CC(=O)C2=CC=CC=C2
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MOLECULAR FORMULA: C20H18N2O4
MOLECULAR WEIGHT: 350.36792
SMILES: CC12CC3=C(C(=CO3)C(=O)OC)C(=O)N1CCC4=C2NC5=CC=CC=C45
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MOLECULAR FORMULA: C25H30N4O3
MOLECULAR WEIGHT: 434.5307
SMILES: CCN(CC)CCNC(=O)C1=COC2=C1C(=O)N3CCC4=C(C3(C2)C)NC5=CC=CC=C45
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MOLECULAR FORMULA: C19H16N2O4
MOLECULAR WEIGHT: 336.34134
SMILES: CC12CC3=C(C(=CO3)C(=O)O)C(=O)N1CCC4=C2NC5=CC=CC=C45
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MOLECULAR FORMULA: C18H16N2O2
MOLECULAR WEIGHT: 292.33184
SMILES: CC12CC3=C(C=CO3)C(=O)N1CCC4=C2NC5=CC=CC=C45
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Product OPENEYE NAME: 10-(3-methoxyphenyl)-5H-phenarsazinine
CAS Name: 10-(3-methoxyphenyl)-5H-phenarsazinine
IUPAC NAME: 10-(3-methoxyphenyl)-5H-phenarsazinine
SYSTEMATIC NAME: 10-(3-methoxyphenyl)-5H-phenarsazinine
MOLECULAR FORMULA: C19H16AsNO
MOLECULAR WEIGHT: 349.25804
SMILES: COC1=CC(=CC=C1)[As]2C3=CC=CC=C3NC4=CC=CC=C42
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Product OPENEYE NAME: (Z)-phenyl-(2-thioxo-3H-benzimidazol-5-ylidene)methanolate
CAS Name: (Z)-phenyl-(2-sulfanylidene-3H-benzimidazol-5-ylidene)methanolate
IUPAC NAME: (Z)-phenyl-(2-sulfanylidene-3H-benzimidazol-5-ylidene)methanolate
SYSTEMATIC NAME: (Z)-phenyl-(2-sulfanylidene-3H-benzimidazol-5-ylidene)methanolate
MOLECULAR FORMULA: C14H9N2OS-
MOLECULAR WEIGHT: 253.29906
SMILES: C1=CC=C(C=C1)/C(=C/2\C=CC3=NC(=S)NC3=C2)/[O-]
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Product OPENEYE NAME: 6-[(6-benzoyl-1H-benzimidazol-2-yl)sulfanyl]hexanoic acid
CAS Name: 6-[(6-benzoyl-1H-benzimidazol-2-yl)thio]hexanoic acid
IUPAC NAME: 6-[(6-benzoyl-1H-benzimidazol-2-yl)sulfanyl]hexanoic acid
SYSTEMATIC NAME: 6-[[6-(phenylcarbonyl)-1H-benzimidazol-2-yl]sulfanyl]hexanoic acid
MOLECULAR FORMULA: C20H20N2O3S
MOLECULAR WEIGHT: 368.4494
SMILES: C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2)N=C(N3)SCCCCCC(=O)O
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Product OPENEYE NAME: 3-[(E)-2-(3-benzyloxyphenyl)vinyl]-7-(dimethylamino)-1,4-benzoxazin-2-one
CAS Name: 7-(dimethylamino)-3-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]-1,4-benzoxazin-2-one
IUPAC NAME: 7-(dimethylamino)-3-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]-1,4-benzoxazin-2-one
SYSTEMATIC NAME: 7-(dimethylamino)-3-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]-1,4-benzoxazin-2-one
MOLECULAR FORMULA: C25H22N2O3
MOLECULAR WEIGHT: 398.45378
SMILES: CN(C)C1=CC2=C(C=C1)N=C(C(=O)O2)/C=C/C3=CC(=CC=C3)OCC4=CC=CC=C4
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Product OPENEYE NAME: ethyl (1E)-N-(2,4-dinitrophenyl)-2-oxo-2-phenyl-ethanehydrazonate
CAS Name: (1E)-N-(2,4-dinitrophenyl)-2-oxo-2-phenylethanehydrazonic acid ethyl ester
IUPAC NAME: ethyl (1E)-N-(2,4-dinitrophenyl)-2-oxo-2-phenylethanehydrazonate
SYSTEMATIC NAME: ethyl (1E)-N-(2,4-dinitrophenyl)-2-oxidanylidene-2-phenyl-ethanehydrazonate
MOLECULAR FORMULA: C16H14N4O6
MOLECULAR WEIGHT: 358.30556
SMILES: CCO/C(=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/C(=O)C2=CC=CC=C2
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Product OPENEYE NAME: diethyl (2Z)-2-[(2,4-dinitrophenyl)hydrazono]pentanedioate
CAS Name: (2Z)-2-[(2,4-dinitrophenyl)hydrazinylidene]pentanedioic acid diethyl ester
IUPAC NAME: diethyl (2Z)-2-[(2,4-dinitrophenyl)hydrazinylidene]pentanedioate
SYSTEMATIC NAME: diethyl (2Z)-2-[(2,4-dinitrophenyl)hydrazinylidene]pentanedioate
MOLECULAR FORMULA: C15H18N4O8
MOLECULAR WEIGHT: 382.32542
SMILES: CCOC(=O)CC/C(=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/C(=O)OCC
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Product OPENEYE NAME: ethyl (E,2Z)-2-[(2,4-dinitrophenyl)hydrazono]-4-phenyl-but-3-enoate
CAS Name: (E,2Z)-2-[(2,4-dinitrophenyl)hydrazinylidene]-4-phenyl-3-butenoic acid ethyl ester
IUPAC NAME: ethyl (E,2Z)-2-[(2,4-dinitrophenyl)hydrazinylidene]-4-phenylbut-3-enoate
SYSTEMATIC NAME: ethyl (E,2Z)-2-[(2,4-dinitrophenyl)hydrazinylidene]-4-phenyl-but-3-enoate
MOLECULAR FORMULA: C18H16N4O6
MOLECULAR WEIGHT: 384.34284
SMILES: CCOC(=O)/C(=N\NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/C=C/C2=CC=CC=C2
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Product OPENEYE NAME: dimethyl (1R,4R)-4-amino-6-methyl-7-thia-5-azabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate
CAS Name: (1R,4R)-4-amino-6-methyl-7-thia-5-azabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylic acid dimethyl ester
IUPAC NAME: dimethyl (1R,4R)-4-amino-6-methyl-7-thia-5-azabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate
SYSTEMATIC NAME: dimethyl (1R,4R)-4-azanyl-6-methyl-7-thia-5-azabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate
MOLECULAR FORMULA: C10H12N2O4S
MOLECULAR WEIGHT: 256.27828
SMILES: CC1=N[C@@]2(C(=C([C@H]1S2)C(=O)OC)C(=O)OC)N
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Product OPENEYE NAME: ethyl N-(1-acetyl-2-chloro-2-methyl-propyl)-N-methyl-carbamate
CAS Name: N-(2-chloro-2-methyl-4-oxopentan-3-yl)-N-methylcarbamic acid ethyl ester
IUPAC NAME: ethyl N-(2-chloro-2-methyl-4-oxopentan-3-yl)-N-methylcarbamate
SYSTEMATIC NAME: ethyl N-(2-chloranyl-2-methyl-4-oxidanylidene-pentan-3-yl)-N-methyl-carbamate
MOLECULAR FORMULA: C10H18ClNO3
MOLECULAR WEIGHT: 235.70782
SMILES: CCOC(=O)N(C)C(C(=O)C)C(C)(C)Cl
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Product OPENEYE NAME: ethyl N-(1-acetyl-2-methyl-prop-1-enyl)-N-methyl-carbamate
CAS Name: N-methyl-N-(2-methyl-4-oxopent-2-en-3-yl)carbamic acid ethyl ester
IUPAC NAME: ethyl N-methyl-N-(2-methyl-4-oxopent-2-en-3-yl)carbamate
SYSTEMATIC NAME: ethyl N-methyl-N-(2-methyl-4-oxidanylidene-pent-2-en-3-yl)carbamate
MOLECULAR FORMULA: C10H17NO3
MOLECULAR WEIGHT: 199.24688
SMILES: CCOC(=O)N(C)C(=C(C)C)C(=O)C
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Product OPENEYE NAME: ethyl N-benzyl-N-(1-isopropenyl-2-methyl-allyl)carbamate
CAS Name: N-(2,4-dimethylpenta-1,4-dien-3-yl)-N-(phenylmethyl)carbamic acid ethyl ester
IUPAC NAME: ethyl N-benzyl-N-(2,4-dimethylpenta-1,4-dien-3-yl)carbamate
SYSTEMATIC NAME: ethyl N-(2,4-dimethylpenta-1,4-dien-3-yl)-N-(phenylmethyl)carbamate
MOLECULAR FORMULA: C17H23NO2
MOLECULAR WEIGHT: 273.37002
SMILES: CCOC(=O)N(CC1=CC=CC=C1)C(C(=C)C)C(=C)C
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Product OPENEYE NAME: ethyl 2-(tert-butylamino)-3-methyl-but-3-enoate
CAS Name: 2-(tert-butylamino)-3-methyl-3-butenoic acid ethyl ester
IUPAC NAME: ethyl 2-(tert-butylamino)-3-methylbut-3-enoate
SYSTEMATIC NAME: ethyl 2-(tert-butylamino)-3-methyl-but-3-enoate
MOLECULAR FORMULA: C11H21NO2
MOLECULAR WEIGHT: 199.28994
SMILES: CCOC(=O)C(C(=C)C)NC(C)(C)C
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Product OPENEYE NAME: ethyl 3,3-dimethylaziridine-2-carboxylate
CAS Name: 3,3-dimethyl-2-aziridinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 3,3-dimethylaziridine-2-carboxylate
SYSTEMATIC NAME: ethyl 3,3-dimethylaziridine-2-carboxylate
MOLECULAR FORMULA: C7H13NO2
MOLECULAR WEIGHT: 143.18362
SMILES: CCOC(=O)C1C(N1)(C)C
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Product OPENEYE NAME: diethyl 3,3-dimethylaziridine-1,2-dicarboxylate
CAS Name: 3,3-dimethylaziridine-1,2-dicarboxylic acid diethyl ester
IUPAC NAME: diethyl 3,3-dimethylaziridine-1,2-dicarboxylate
SYSTEMATIC NAME: diethyl 3,3-dimethylaziridine-1,2-dicarboxylate
MOLECULAR FORMULA: C10H17NO4
MOLECULAR WEIGHT: 215.24628
SMILES: CCOC(=O)C1C(N1C(=O)OCC)(C)C
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Product OPENEYE NAME: ethyl 1-[(Z)-3-ethoxy-3-oxo-prop-1-enyl]-3,3-dimethyl-aziridine-2-carboxylate
CAS Name: 1-[(Z)-3-ethoxy-3-oxoprop-1-enyl]-3,3-dimethyl-2-aziridinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 1-[(Z)-3-ethoxy-3-oxoprop-1-enyl]-3,3-dimethylaziridine-2-carboxylate
SYSTEMATIC NAME: ethyl 1-[(Z)-3-ethoxy-3-oxidanylidene-prop-1-enyl]-3,3-dimethyl-aziridine-2-carboxylate
MOLECULAR FORMULA: C12H19NO4
MOLECULAR WEIGHT: 241.28356
SMILES: CCOC(=O)/C=C\N1C(C1(C)C)C(=O)OCC
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Product OPENEYE NAME: 1-(3,3-dimethylaziridin-2-yl)ethanone
CAS Name: 1-(3,3-dimethyl-2-aziridinyl)ethanone
IUPAC NAME: 1-(3,3-dimethylaziridin-2-yl)ethanone
SYSTEMATIC NAME: 1-(3,3-dimethylaziridin-2-yl)ethanone
MOLECULAR FORMULA: C6H11NO
MOLECULAR WEIGHT: 113.15764
SMILES: CC(=O)C1C(N1)(C)C
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Product OPENEYE NAME: 1-(1,3,3-trimethylaziridin-2-yl)ethanone
CAS Name: 1-(1,3,3-trimethyl-2-aziridinyl)ethanone
IUPAC NAME: 1-(1,3,3-trimethylaziridin-2-yl)ethanone
SYSTEMATIC NAME: 1-(1,3,3-trimethylaziridin-2-yl)ethanone
MOLECULAR FORMULA: C7H13NO
MOLECULAR WEIGHT: 127.18422
SMILES: CC(=O)C1C(N1C)(C)C
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Product OPENEYE NAME: 1-(1-ethyl-3,3-dimethyl-aziridin-2-yl)ethanone
CAS Name: 1-(1-ethyl-3,3-dimethyl-2-aziridinyl)ethanone
IUPAC NAME: 1-(1-ethyl-3,3-dimethylaziridin-2-yl)ethanone
SYSTEMATIC NAME: 1-(1-ethyl-3,3-dimethyl-aziridin-2-yl)ethanone
MOLECULAR FORMULA: C8H15NO
MOLECULAR WEIGHT: 141.2108
SMILES: CCN1C(C1(C)C)C(=O)C
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