Tuesday, September 25, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 2-carboxyallyl-hydroxy-oxo-phosphonium
CAS Name: 2-carboxyprop-2-enyl-hydroxy-oxophosphonium
IUPAC NAME: 2-carboxyprop-2-enyl-hydroxy-oxophosphanium
SYSTEMATIC NAME: 2-carboxyprop-2-enyl-oxidanyl-oxidanylidene-phosphanium
MOLECULAR FORMULA: C4H6O4P+
MOLECULAR WEIGHT: 149.061801
SMILES: C=C(C[P+](=O)O)C(=O)O
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Product OPENEYE NAME: methyl 4-(benzyloxycarbonylamino)-2,3-dimethyl-pentanoate
CAS Name: 2,3-dimethyl-4-(phenylmethoxycarbonylamino)pentanoic acid methyl ester
IUPAC NAME: methyl 2,3-dimethyl-4-(phenylmethoxycarbonylamino)pentanoate
SYSTEMATIC NAME: methyl 2,3-dimethyl-4-(phenylmethoxycarbonylamino)pentanoate
MOLECULAR FORMULA: C16H23NO4
MOLECULAR WEIGHT: 293.35812
SMILES: CC(C(C)C(=O)OC)C(C)NC(=O)OCC1=CC=CC=C1
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Product OPENEYE NAME: 5-(2-methoxyphenyl)-2-oxo-3H-furan-4-carboxylic acid
CAS Name: 5-(2-methoxyphenyl)-2-oxo-3H-furan-4-carboxylic acid
IUPAC NAME: 5-(2-methoxyphenyl)-2-oxo-3H-furan-4-carboxylic acid
SYSTEMATIC NAME: 5-(2-methoxyphenyl)-2-oxidanylidene-3H-furan-4-carboxylic acid
MOLECULAR FORMULA: C12H10O5
MOLECULAR WEIGHT: 234.2048
SMILES: COC1=CC=CC=C1C2=C(CC(=O)O2)C(=O)O
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Product OPENEYE NAME: 4-chloro-2-(1-imidazol-1-yloctyl)benzamide
CAS Name: 4-chloro-2-[1-(1-imidazolyl)octyl]benzamide
IUPAC NAME: 4-chloro-2-(1-imidazol-1-yloctyl)benzamide
SYSTEMATIC NAME: 4-chloranyl-2-(1-imidazol-1-yloctyl)benzamide
MOLECULAR FORMULA: C18H24ClN3O
MOLECULAR WEIGHT: 333.85566
SMILES: CCCCCCCC(C1=C(C=CC(=C1)Cl)C(=O)N)N2C=CN=C2
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Product OPENEYE NAME: 4-(hydroxymethyl)-5-(2-methoxyphenyl)tetrahydrofuran-2-one
CAS Name: 4-(hydroxymethyl)-5-(2-methoxyphenyl)-2-oxolanone
IUPAC NAME: 4-(hydroxymethyl)-5-(2-methoxyphenyl)oxolan-2-one
SYSTEMATIC NAME: 4-(hydroxymethyl)-5-(2-methoxyphenyl)oxolan-2-one
MOLECULAR FORMULA: C12H14O4
MOLECULAR WEIGHT: 222.23716
SMILES: COC1=CC=CC=C1C2C(CC(=O)O2)CO
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Product OPENEYE NAME: 2-(2-methoxyphenyl)furan
CAS Name: 2-(2-methoxyphenyl)furan
IUPAC NAME: 2-(2-methoxyphenyl)furan
SYSTEMATIC NAME: 2-(2-methoxyphenyl)furan
MOLECULAR FORMULA: C11H10O2
MOLECULAR WEIGHT: 174.1959
SMILES: COC1=CC=CC=C1C2=CC=CO2
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Product OPENEYE NAME: 2-(5-allyl-2,2-dimethyl-1,3-dioxan-4-yl)phenol
CAS Name: 2-(2,2-dimethyl-5-prop-2-enyl-1,3-dioxan-4-yl)phenol
IUPAC NAME: 2-(2,2-dimethyl-5-prop-2-enyl-1,3-dioxan-4-yl)phenol
SYSTEMATIC NAME: 2-(2,2-dimethyl-5-prop-2-enyl-1,3-dioxan-4-yl)phenol
MOLECULAR FORMULA: C15H20O3
MOLECULAR WEIGHT: 248.3175
SMILES: CC1(OCC(C(O1)C2=CC=CC=C2O)CC=C)C
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Product OPENEYE NAME: 5-(5-fluoro-2-methoxy-phenyl)-4-(hydroxymethyl)tetrahydrofuran-2-ol
CAS Name: 5-(5-fluoro-2-methoxyphenyl)-4-(hydroxymethyl)-2-oxolanol
IUPAC NAME: 5-(5-fluoro-2-methoxyphenyl)-4-(hydroxymethyl)oxolan-2-ol
SYSTEMATIC NAME: 5-(5-fluoranyl-2-methoxy-phenyl)-4-(hydroxymethyl)oxolan-2-ol
MOLECULAR FORMULA: C12H15FO4
MOLECULAR WEIGHT: 242.243503
SMILES: COC1=C(C=C(C=C1)F)C2C(CC(O2)O)CO
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Product OPENEYE NAME: 4-fluoro-4-(2-methoxyphenyl)-2,2-dimethyl-1,3-dioxane
CAS Name: 4-fluoro-4-(2-methoxyphenyl)-2,2-dimethyl-1,3-dioxane
IUPAC NAME: 4-fluoro-4-(2-methoxyphenyl)-2,2-dimethyl-1,3-dioxane
SYSTEMATIC NAME: 4-fluoranyl-4-(2-methoxyphenyl)-2,2-dimethyl-1,3-dioxane
MOLECULAR FORMULA: C13H17FO3
MOLECULAR WEIGHT: 240.270683
SMILES: CC1(OCCC(O1)(C2=CC=CC=C2OC)F)C
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Product OPENEYE NAME: 1-(1,3-dioxan-5-yl)-2-(2-hydroxyphenyl)ethanone
CAS Name: 1-(1,3-dioxan-5-yl)-2-(2-hydroxyphenyl)ethanone
IUPAC NAME: 1-(1,3-dioxan-5-yl)-2-(2-hydroxyphenyl)ethanone
SYSTEMATIC NAME: 1-(1,3-dioxan-5-yl)-2-(2-hydroxyphenyl)ethanone
MOLECULAR FORMULA: C12H14O4
MOLECULAR WEIGHT: 222.23716
SMILES: C1C(COCO1)C(=O)CC2=CC=CC=C2O
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Product OPENEYE NAME: 2-(5-fluoro-2-methoxy-phenyl)-5-oxo-2H-furan-3-carboxylic acid
CAS Name: 2-(5-fluoro-2-methoxyphenyl)-5-oxo-2H-furan-3-carboxylic acid
IUPAC NAME: 2-(5-fluoro-2-methoxyphenyl)-5-oxo-2H-furan-3-carboxylic acid
SYSTEMATIC NAME: 2-(5-fluoranyl-2-methoxy-phenyl)-5-oxidanylidene-2H-furan-3-carboxylic acid
MOLECULAR FORMULA: C12H9FO5
MOLECULAR WEIGHT: 252.195263
SMILES: COC1=C(C=C(C=C1)F)C2C(=CC(=O)O2)C(=O)O
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Product OPENEYE NAME: 2-(4-fluoro-2,2-dimethyl-1,3-dioxan-4-yl)phenol
CAS Name: 2-(4-fluoro-2,2-dimethyl-1,3-dioxan-4-yl)phenol
IUPAC NAME: 2-(4-fluoro-2,2-dimethyl-1,3-dioxan-4-yl)phenol
SYSTEMATIC NAME: 2-(4-fluoranyl-2,2-dimethyl-1,3-dioxan-4-yl)phenol
MOLECULAR FORMULA: C12H15FO3
MOLECULAR WEIGHT: 226.244103
SMILES: CC1(OCCC(O1)(C2=CC=CC=C2O)F)C
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Product OPENEYE NAME: 5-(5-fluoro-2-methoxy-phenyl)-4-(hydroxymethyl)tetrahydrofuran-2-one
CAS Name: 5-(5-fluoro-2-methoxyphenyl)-4-(hydroxymethyl)-2-oxolanone
IUPAC NAME: 5-(5-fluoro-2-methoxyphenyl)-4-(hydroxymethyl)oxolan-2-one
SYSTEMATIC NAME: 5-(5-fluoranyl-2-methoxy-phenyl)-4-(hydroxymethyl)oxolan-2-one
MOLECULAR FORMULA: C12H13FO4
MOLECULAR WEIGHT: 240.227623
SMILES: COC1=C(C=C(C=C1)F)C2C(CC(=O)O2)CO
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