Friday, August 16, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 5-(2-chloro-3,5,6-trifluoro-4-methyl-phenoxy)-2-cyano-benzoic acid
CAS Name: 5-(2-chloro-3,5,6-trifluoro-4-methylphenoxy)-2-cyanobenzoic acid
IUPAC NAME: 5-(2-chloro-3,5,6-trifluoro-4-methylphenoxy)-2-cyanobenzoic acid
SYSTEMATIC NAME: 5-[2-chloranyl-3,5,6-tris(fluoranyl)-4-methyl-phenoxy]-2-cyano-benzoic acid
MOLECULAR FORMULA: C15H7ClF3NO3
MOLECULAR WEIGHT: 341.66919
SMILES: CC1=C(C(=C(C(=C1F)Cl)OC2=CC(=C(C=C2)C#N)C(=O)O)F)F
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Product OPENEYE NAME: 2-chloro-5-[2-(trifluoromethyl)phenoxy]bicyclo[2.2.1]hepta-1(6),2,4-trien-7-one chloride
CAS Name: 2-chloro-5-[2-(trifluoromethyl)phenoxy]-7-bicyclo[2.2.1]hepta-1(6),2,4-trienone chloride
IUPAC NAME: 2-chloro-5-[2-(trifluoromethyl)phenoxy]bicyclo[2.2.1]hepta-1(6),2,4-trien-7-one chloride
SYSTEMATIC NAME: 2-chloranyl-5-[2-(trifluoromethyl)phenoxy]bicyclo[2.2.1]hepta-1(6),2,4-trien-7-one chloride
MOLECULAR FORMULA: C14H6Cl2F3O2-
MOLECULAR WEIGHT: 334.09745
SMILES: C1=CC=C(C(=C1)C(F)(F)F)OC2=C3C=C(C(=C2)C3=O)Cl.[Cl-]
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Product OPENEYE NAME: 2-chloro-5-[2-(trifluoromethyl)phenoxy]bicyclo[2.2.1]hepta-1(6),2,4-trien-7-one
CAS Name: 2-chloro-5-[2-(trifluoromethyl)phenoxy]-7-bicyclo[2.2.1]hepta-1(6),2,4-trienone
IUPAC NAME: 2-chloro-5-[2-(trifluoromethyl)phenoxy]bicyclo[2.2.1]hepta-1(6),2,4-trien-7-one
SYSTEMATIC NAME: 2-chloranyl-5-[2-(trifluoromethyl)phenoxy]bicyclo[2.2.1]hepta-1(6),2,4-trien-7-one
MOLECULAR FORMULA: C14H6ClF3O2
MOLECULAR WEIGHT: 298.64445
SMILES: C1=CC=C(C(=C1)C(F)(F)F)OC2=C3C=C(C(=C2)C3=O)Cl
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Product OPENEYE NAME: phenyl 3-chloro-2-nitro-4-(trifluoromethyl)benzenecarboperoxoate
CAS Name: 3-chloro-2-nitro-4-(trifluoromethyl)benzenecarboperoxoic acid phenyl ester
IUPAC NAME: phenyl 3-chloro-2-nitro-4-(trifluoromethyl)benzenecarboperoxoate
SYSTEMATIC NAME: phenyl 3-chloranyl-2-nitro-4-(trifluoromethyl)benzenecarboperoxoate
MOLECULAR FORMULA: C14H7ClF3NO5
MOLECULAR WEIGHT: 361.65729
SMILES: C1=CC=C(C=C1)OOC(=O)C2=C(C(=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]
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Product OPENEYE NAME: (3-hydroxy-2-methyl-propyl) 4-acetoxy-3-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate
CAS Name: 4-acetyloxy-3-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoic acid (3-hydroxy-2-methylpropyl) ester
IUPAC NAME: (3-hydroxy-2-methylpropyl) 4-acetyloxy-3-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoate
SYSTEMATIC NAME: (2-methyl-3-oxidanyl-propyl) 4-acetyloxy-3-chloranyl-5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate
MOLECULAR FORMULA: C20H16Cl2F3NO8
MOLECULAR WEIGHT: 526.24415
SMILES: CC(CO)COC(=O)C1=CC(=C(C(=C1[N+](=O)[O-])Cl)OC(=O)C)OC2=C(C=C(C=C2)C(F)(F)F)Cl
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Product OPENEYE NAME: 2,3-dianilinoterephthalate
CAS Name: 2,3-dianilinoterephthalate
IUPAC NAME: 2,3-dianilinoterephthalate
SYSTEMATIC NAME: 2,3-bis(phenylazanyl)terephthalate
MOLECULAR FORMULA: C20H14N2O4-2
MOLECULAR WEIGHT: 346.33616
SMILES: C1=CC=C(C=C1)NC2=C(C=CC(=C2NC3=CC=CC=C3)C(=O)[O-])C(=O)[O-]
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Product OPENEYE NAME: 2,3-dianilinoterephthalic acid
CAS Name: 2,3-dianilinoterephthalic acid
IUPAC NAME: 2,3-dianilinoterephthalic acid
SYSTEMATIC NAME: 2,3-bis(phenylazanyl)terephthalic acid
MOLECULAR FORMULA: C20H16N2O4
MOLECULAR WEIGHT: 348.35204
SMILES: C1=CC=C(C=C1)NC2=C(C=CC(=C2NC3=CC=CC=C3)C(=O)O)C(=O)O
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Product OPENEYE NAME: 2,3-dianilino-5,6-dichloro-terephthalic acid
CAS Name: 2,3-dianilino-5,6-dichloroterephthalic acid
IUPAC NAME: 2,3-dianilino-5,6-dichloroterephthalic acid
SYSTEMATIC NAME: 2,3-bis(chloranyl)-5,6-bis(phenylazanyl)terephthalic acid
MOLECULAR FORMULA: C20H14Cl2N2O4
MOLECULAR WEIGHT: 417.24216
SMILES: C1=CC=C(C=C1)NC2=C(C(=C(C(=C2NC3=CC=CC=C3)C(=O)O)Cl)Cl)C(=O)O
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Product OPENEYE NAME: dimethyl 3,4-dianilinocyclohexa-1,5-diene-1,4-dicarboxylate
CAS Name: 3,4-dianilinocyclohexa-1,5-diene-1,4-dicarboxylic acid dimethyl ester
IUPAC NAME: dimethyl 3,4-dianilinocyclohexa-1,5-diene-1,4-dicarboxylate
SYSTEMATIC NAME: dimethyl 3,4-bis(phenylazanyl)cyclohexa-1,5-diene-1,4-dicarboxylate
MOLECULAR FORMULA: C22H22N2O4
MOLECULAR WEIGHT: 378.42108
SMILES: COC(=O)C1=CC(C(C=C1)(C(=O)OC)NC2=CC=CC=C2)NC3=CC=CC=C3
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Product OPENEYE NAME: 2,3-bis(4-methylanilino)terephthalic acid
CAS Name: 2,3-bis(4-methylanilino)terephthalic acid
IUPAC NAME: 2,3-bis(4-methylanilino)terephthalic acid
SYSTEMATIC NAME: 2,3-bis[(4-methylphenyl)amino]terephthalic acid
MOLECULAR FORMULA: C22H20N2O4
MOLECULAR WEIGHT: 376.4052
SMILES: CC1=CC=C(C=C1)NC2=C(C=CC(=C2NC3=CC=C(C=C3)C)C(=O)O)C(=O)O
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Product OPENEYE NAME: 3,4-dianilinocyclohexa-1,5-diene-1,4-dicarboxylic acid
CAS Name: 3,4-dianilinocyclohexa-1,5-diene-1,4-dicarboxylic acid
IUPAC NAME: 3,4-dianilinocyclohexa-1,5-diene-1,4-dicarboxylic acid
SYSTEMATIC NAME: 3,4-bis(phenylazanyl)cyclohexa-1,5-diene-1,4-dicarboxylic acid
MOLECULAR FORMULA: C20H18N2O4
MOLECULAR WEIGHT: 350.36792
SMILES: C1=CC=C(C=C1)NC2C=C(C=CC2(C(=O)O)NC3=CC=CC=C3)C(=O)O
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Product OPENEYE NAME: 2-(2,3-dichloroanilino)terephthalic acid
CAS Name: 2-(2,3-dichloroanilino)terephthalic acid
IUPAC NAME: 2-(2,3-dichloroanilino)terephthalic acid
SYSTEMATIC NAME: 2-[[2,3-bis(chloranyl)phenyl]amino]terephthalic acid
MOLECULAR FORMULA: C14H9Cl2NO4
MOLECULAR WEIGHT: 326.13156
SMILES: C1=CC(=C(C(=C1)Cl)Cl)NC2=C(C=CC(=C2)C(=O)O)C(=O)O
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Product OPENEYE NAME: [3-[2-(3-acetylperoxyphenyl)ethyl]phenyl] peroxyacetate
CAS Name: ethaneperoxoic acid [3-[2-(3-acetyldioxyphenyl)ethyl]phenyl] ester
IUPAC NAME: [3-[2-(3-acetylperoxyphenyl)ethyl]phenyl] ethaneperoxoate
SYSTEMATIC NAME: [3-[2-(3-ethanoylperoxyphenyl)ethyl]phenyl] ethaneperoxoate
MOLECULAR FORMULA: C18H18O6
MOLECULAR WEIGHT: 330.33192
SMILES: CC(=O)OOC1=CC=CC(=C1)CCC2=CC(=CC=C2)OOC(=O)C
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Product OPENEYE NAME: 2-(4-isobutylphenyl)propyl 3,4,5-trimethoxybenzoate
CAS Name: 3,4,5-trimethoxybenzoic acid 2-[4-(2-methylpropyl)phenyl]propyl ester
IUPAC NAME: 2-[4-(2-methylpropyl)phenyl]propyl 3,4,5-trimethoxybenzoate
SYSTEMATIC NAME: 2-[4-(2-methylpropyl)phenyl]propyl 3,4,5-trimethoxybenzoate
MOLECULAR FORMULA: C23H30O5
MOLECULAR WEIGHT: 386.4813
SMILES: CC(C)CC1=CC=C(C=C1)C(C)COC(=O)C2=CC(=C(C(=C2)OC)OC)OC
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Product OPENEYE NAME: anthracene-1,5,9-tricarboxylic acid
CAS Name: anthracene-1,5,9-tricarboxylic acid
IUPAC NAME: anthracene-1,5,9-tricarboxylic acid
SYSTEMATIC NAME: anthracene-1,5,9-tricarboxylic acid
MOLECULAR FORMULA: C17H10O6
MOLECULAR WEIGHT: 310.2577
SMILES: C1=CC2=CC3=C(C=CC=C3C(=O)O)C(=C2C(=C1)C(=O)O)C(=O)O
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Product OPENEYE NAME: 2,4-dibutylbenzene-1,3,5-tricarboxylic acid
CAS Name: 2,4-dibutylbenzene-1,3,5-tricarboxylic acid
IUPAC NAME: 2,4-dibutylbenzene-1,3,5-tricarboxylic acid
SYSTEMATIC NAME: 2,4-dibutylbenzene-1,3,5-tricarboxylic acid
MOLECULAR FORMULA: C17H22O6
MOLECULAR WEIGHT: 322.35298
SMILES: CCCCC1=C(C(=C(C=C1C(=O)O)C(=O)O)CCCC)C(=O)O
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Product OPENEYE NAME: 2-ethyl-4-hexyl-6-methyl-benzene-1,3-dicarboxylic acid
CAS Name: 2-ethyl-4-hexyl-6-methylbenzene-1,3-dicarboxylic acid
IUPAC NAME: 2-ethyl-4-hexyl-6-methylbenzene-1,3-dicarboxylic acid
SYSTEMATIC NAME: 2-ethyl-4-hexyl-6-methyl-benzene-1,3-dicarboxylic acid
MOLECULAR FORMULA: C17H24O4
MOLECULAR WEIGHT: 292.37006
SMILES: CCCCCCC1=C(C(=C(C(=C1)C)C(=O)O)CC)C(=O)O
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Product OPENEYE NAME: 4-[[4-hydroxy-2,3-bis(hydroxymethyl)phenyl]methyl]-2,3-bis(hydroxymethyl)phenol
CAS Name: 4-[[4-hydroxy-2,3-bis(hydroxymethyl)phenyl]methyl]-2,3-bis(hydroxymethyl)phenol
IUPAC NAME: 4-[[4-hydroxy-2,3-bis(hydroxymethyl)phenyl]methyl]-2,3-bis(hydroxymethyl)phenol
SYSTEMATIC NAME: 4-[[2,3-bis(hydroxymethyl)-4-oxidanyl-phenyl]methyl]-2,3-bis(hydroxymethyl)phenol
MOLECULAR FORMULA: C17H20O6
MOLECULAR WEIGHT: 320.3371
SMILES: C1=CC(=C(C(=C1CC2=C(C(=C(C=C2)O)CO)CO)CO)CO)O
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Product OPENEYE NAME: 2,4,6-tris(hydroxymethyl)phenolate
CAS Name: 2,4,6-tris(hydroxymethyl)phenolate
IUPAC NAME: 2,4,6-tris(hydroxymethyl)phenolate
SYSTEMATIC NAME: 2,4,6-tris(hydroxymethyl)phenolate
MOLECULAR FORMULA: C9H11O4-
MOLECULAR WEIGHT: 183.18124
SMILES: C1=C(C=C(C(=C1CO)[O-])CO)CO
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