Product OPENEYE NAME: ethyl 3-(bromomethyl)-5-(2-ethoxy-2-oxo-acetyl)-1-methyl-pyrrole-2-carboxylate
CAS Name: 3-(bromomethyl)-5-(2-ethoxy-1,2-dioxoethyl)-1-methyl-2-pyrrolecarboxylic acid ethyl ester
IUPAC NAME: ethyl 3-(bromomethyl)-5-(2-ethoxy-2-oxoacetyl)-1-methylpyrrole-2-carboxylate
SYSTEMATIC NAME: ethyl 3-(bromomethyl)-5-(2-ethoxy-2-oxidanylidene-ethanoyl)-1-methyl-pyrrole-2-carboxylate
MOLECULAR FORMULA: C13H16BrNO5
MOLECULAR WEIGHT: 346.17384
SMILES: CCOC(=O)C1=C(C=C(N1C)C(=O)C(=O)OCC)CBr
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Product OPENEYE NAME: 2-(2-bromoacetyl)-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
CAS Name: 2-(2-bromo-1-oxoethyl)-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
IUPAC NAME: 2-(2-bromoacetyl)-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
SYSTEMATIC NAME: 2-(2-bromanylethanoyl)-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
MOLECULAR FORMULA: C16H14BrNO3
MOLECULAR WEIGHT: 348.19126
SMILES: CC1=CC2=C(C=C1)C(=O)C3=C(CO2)C=C(N3C)C(=O)CBr
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Product OPENEYE NAME: 2-(2,3-dihydroxybutyl)-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
CAS Name: 2-(2,3-dihydroxybutyl)-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
IUPAC NAME: 2-(2,3-dihydroxybutyl)-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
SYSTEMATIC NAME: 2-[2,3-bis(oxidanyl)butyl]-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
MOLECULAR FORMULA: C18H21NO4
MOLECULAR WEIGHT: 315.36364
SMILES: CC1=CC2=C(C=C1)C(=O)C3=C(CO2)C=C(N3C)CC(C(C)O)O
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Product OPENEYE NAME: 2-[[3-[(1,7-dimethyl-10-oxo-4H-[1]benzoxepino[4,3-b]pyrrol-2-yl)methoxy]-2-oxo-propoxy]methyl]-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
CAS Name: 2-[[3-[(1,7-dimethyl-10-oxo-4H-[1]benzoxepino[4,3-b]pyrrol-2-yl)methoxy]-2-oxopropoxy]methyl]-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
IUPAC NAME: 2-[[3-[(1,7-dimethyl-10-oxo-4H-[1]benzoxepino[4,3-b]pyrrol-2-yl)methoxy]-2-oxopropoxy]methyl]-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
SYSTEMATIC NAME: 2-[[3-[(1,7-dimethyl-10-oxidanylidene-4H-[1]benzoxepino[4,3-b]pyrrol-2-yl)methoxy]-2-oxidanylidene-propoxy]methyl]-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
MOLECULAR FORMULA: C33H32N2O7
MOLECULAR WEIGHT: 568.61638
SMILES: CC1=CC2=C(C=C1)C(=O)C3=C(CO2)C=C(N3C)COCC(=O)COCC4=CC5=C(N4C)C(=O)C6=C(C=C(C=C6)C)OC5
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Product OPENEYE NAME: 3-(bromomethyl)-1H-pyrrole
CAS Name: 3-(bromomethyl)-1H-pyrrole
IUPAC NAME: 3-(bromomethyl)-1H-pyrrole
SYSTEMATIC NAME: 3-(bromomethyl)-1H-pyrrole
MOLECULAR FORMULA: C5H6BrN
MOLECULAR WEIGHT: 160.01184
SMILES: C1=CNC=C1CBr
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Product OPENEYE NAME: 2-(chloromethyl)-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
CAS Name: 2-(chloromethyl)-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
IUPAC NAME: 2-(chloromethyl)-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
SYSTEMATIC NAME: 2-(chloromethyl)-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
MOLECULAR FORMULA: C15H14ClNO2
MOLECULAR WEIGHT: 275.73016
SMILES: CC1=CC2=C(C=C1)C(=O)C3=C(CO2)C=C(N3C)CCl
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Product OPENEYE NAME: 1,7-dimethyl-2-(2,2,2-triethoxyethyl)-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
CAS Name: 1,7-dimethyl-2-(2,2,2-triethoxyethyl)-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
IUPAC NAME: 1,7-dimethyl-2-(2,2,2-triethoxyethyl)-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
SYSTEMATIC NAME: 1,7-dimethyl-2-(2,2,2-triethoxyethyl)-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
MOLECULAR FORMULA: C22H29NO5
MOLECULAR WEIGHT: 387.46936
SMILES: CCOC(CC1=CC2=C(N1C)C(=O)C3=C(C=C(C=C3)C)OC2)(OCC)OCC
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Product OPENEYE NAME: 2-(1H-[1]benzoxepino[4,3-b]pyrrol-2-yl)acetic acid
CAS Name: 2-(1H-[1]benzoxepino[4,3-b]pyrrol-2-yl)acetic acid
IUPAC NAME: 2-(1H-[1]benzoxepino[4,3-b]pyrrol-2-yl)acetic acid
SYSTEMATIC NAME: 2-(1H-[1]benzoxepino[4,3-b]pyrrol-2-yl)ethanoic acid
MOLECULAR FORMULA: C14H11NO3
MOLECULAR WEIGHT: 241.24204
SMILES: C1=CC=C2C(=C1)C=C3C(=CO2)C=C(N3)CC(=O)O
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Product OPENEYE NAME: 2-acetyl-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
CAS Name: 2-acetyl-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
IUPAC NAME: 2-acetyl-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
SYSTEMATIC NAME: 2-ethanoyl-1,7-dimethyl-4H-[1]benzoxepino[4,3-b]pyrrol-10-one
MOLECULAR FORMULA: C16H15NO3
MOLECULAR WEIGHT: 269.2952
SMILES: CC1=CC2=C(C=C1)C(=O)C3=C(CO2)C=C(N3C)C(=O)C
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Product OPENEYE NAME: tert-butyl 2-(1,7-dimethyl-10-oxo-4H-[1]benzoxepino[4,3-b]pyrrol-2-yl)acetate
CAS Name: 2-(1,7-dimethyl-10-oxo-4H-[1]benzoxepino[4,3-b]pyrrol-2-yl)acetic acid tert-butyl ester
IUPAC NAME: tert-butyl 2-(1,7-dimethyl-10-oxo-4H-[1]benzoxepino[4,3-b]pyrrol-2-yl)acetate
SYSTEMATIC NAME: tert-butyl 2-(1,7-dimethyl-10-oxidanylidene-4H-[1]benzoxepino[4,3-b]pyrrol-2-yl)ethanoate
MOLECULAR FORMULA: C20H23NO4
MOLECULAR WEIGHT: 341.40092
SMILES: CC1=CC2=C(C=C1)C(=O)C3=C(CO2)C=C(N3C)CC(=O)OC(C)(C)C
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Product OPENEYE NAME: 2-(carboxymethyl)-1-methyl-10-oxo-9a,10a-dihydro-3aH-[2]benzoxepino[4,3-b]pyrrole-3-carboxylic acid
CAS Name: 2-(carboxymethyl)-1-methyl-10-oxo-9a,10a-dihydro-3aH-[2]benzoxepino[4,3-b]pyrrole-3-carboxylic acid
IUPAC NAME: 2-(carboxymethyl)-1-methyl-10-oxo-9a,10a-dihydro-3aH-[2]benzoxepino[4,3-b]pyrrole-3-carboxylic acid
SYSTEMATIC NAME: 2-(2-hydroxy-2-oxoethyl)-1-methyl-10-oxidanylidene-9a,10a-dihydro-3aH-[2]benzoxepino[4,3-b]pyrrole-3-carboxylic acid
MOLECULAR FORMULA: C16H15NO6
MOLECULAR WEIGHT: 317.2934
SMILES: CN1C2C(C(=C1CC(=O)O)C(=O)O)OC=C3C=CC=CC3C2=O
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Product OPENEYE NAME: (4Z)-4-hydroxyimino-8-methyl-2,3-dihydro-1-benzoxepin-5-one
CAS Name: (4Z)-4-hydroxyimino-8-methyl-2,3-dihydro-1-benzoxepin-5-one
IUPAC NAME: (4Z)-4-hydroxyimino-8-methyl-2,3-dihydro-1-benzoxepin-5-one
SYSTEMATIC NAME: (4Z)-4-hydroxyimino-8-methyl-2,3-dihydro-1-benzoxepin-5-one
MOLECULAR FORMULA: C11H11NO3
MOLECULAR WEIGHT: 205.20994
SMILES: CC1=CC2=C(C=C1)C(=O)/C(=N\O)/CCO2
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Product OPENEYE NAME: 2-(1,7-dimethyl-10-oxo-4H-[1]benzoxepino[4,3-b]pyrrol-2-yl)acetyl chloride
CAS Name: 2-(1,7-dimethyl-10-oxo-4H-[1]benzoxepino[4,3-b]pyrrol-2-yl)acetyl chloride
IUPAC NAME: 2-(1,7-dimethyl-10-oxo-4H-[1]benzoxepino[4,3-b]pyrrol-2-yl)acetyl chloride
SYSTEMATIC NAME: 2-(1,7-dimethyl-10-oxidanylidene-4H-[1]benzoxepino[4,3-b]pyrrol-2-yl)ethanoyl chloride
MOLECULAR FORMULA: C16H14ClNO3
MOLECULAR WEIGHT: 303.74026
SMILES: CC1=CC2=C(C=C1)C(=O)C3=C(CO2)C=C(N3C)CC(=O)Cl
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-3,3-dimethyl-N-(5-oxotetrahydrofuran-3-yl)oxirane-2-carboxamide
CAS Name: N-(2,6-dimethylphenyl)-3,3-dimethyl-N-(5-oxo-3-oxolanyl)-2-oxiranecarboxamide
IUPAC NAME: N-(2,6-dimethylphenyl)-3,3-dimethyl-N-(5-oxooxolan-3-yl)oxirane-2-carboxamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-3,3-dimethyl-N-(5-oxidanylideneoxolan-3-yl)oxirane-2-carboxamide
MOLECULAR FORMULA: C17H21NO4
MOLECULAR WEIGHT: 303.35294
SMILES: CC1=C(C(=CC=C1)C)N(C2CC(=O)OC2)C(=O)C3C(O3)(C)C
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Product OPENEYE NAME: (E)-N-(2,6-dimethylphenyl)-N-(5-oxotetrahydrofuran-3-yl)but-2-enamide
CAS Name: (E)-N-(2,6-dimethylphenyl)-N-(5-oxo-3-oxolanyl)-2-butenamide
IUPAC NAME: (E)-N-(2,6-dimethylphenyl)-N-(5-oxooxolan-3-yl)but-2-enamide
SYSTEMATIC NAME: (E)-N-(2,6-dimethylphenyl)-N-(5-oxidanylideneoxolan-3-yl)but-2-enamide
MOLECULAR FORMULA: C16H19NO3
MOLECULAR WEIGHT: 273.32696
SMILES: C/C=C/C(=O)N(C1CC(=O)OC1)C2=C(C=CC=C2C)C
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-N-(5-oxo-2-thioxo-tetrahydrofuran-3-yl)prop-2-enamide
CAS Name: N-(2,6-dimethylphenyl)-N-(5-oxo-2-sulfanylidene-3-oxolanyl)-2-propenamide
IUPAC NAME: N-(2,6-dimethylphenyl)-N-(5-oxo-2-sulfanylideneoxolan-3-yl)prop-2-enamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-N-(5-oxidanylidene-2-sulfanylidene-oxolan-3-yl)prop-2-enamide
MOLECULAR FORMULA: C15H15NO3S
MOLECULAR WEIGHT: 289.3495
SMILES: CC1=C(C(=CC=C1)C)N(C2CC(=O)OC2=S)C(=O)C=C
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Product OPENEYE NAME: N-(2,6-dimethylphenyl)-2-methyl-N-(5-oxotetrahydrofuran-3-yl)oxirane-2-carboxamide
CAS Name: N-(2,6-dimethylphenyl)-2-methyl-N-(5-oxo-3-oxolanyl)-2-oxiranecarboxamide
IUPAC NAME: N-(2,6-dimethylphenyl)-2-methyl-N-(5-oxooxolan-3-yl)oxirane-2-carboxamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2-methyl-N-(5-oxidanylideneoxolan-3-yl)oxirane-2-carboxamide
MOLECULAR FORMULA: C16H19NO4
MOLECULAR WEIGHT: 289.32636
SMILES: CC1=C(C(=CC=C1)C)N(C2CC(=O)OC2)C(=O)C3(CO3)C
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Product OPENEYE NAME: 2-methoxy-N-(2-methyl-1-naphthyl)-N-(5-oxotetrahydrofuran-3-yl)acetamide
CAS Name: 2-methoxy-N-(2-methyl-1-naphthalenyl)-N-(5-oxo-3-oxolanyl)acetamide
IUPAC NAME: 2-methoxy-N-(2-methylnaphthalen-1-yl)-N-(5-oxooxolan-3-yl)acetamide
SYSTEMATIC NAME: 2-methoxy-N-(2-methylnaphthalen-1-yl)-N-(5-oxidanylideneoxolan-3-yl)ethanamide
MOLECULAR FORMULA: C18H19NO4
MOLECULAR WEIGHT: 313.34776
SMILES: CC1=C(C2=CC=CC=C2C=C1)N(C3CC(=O)OC3)C(=O)COC
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