Saturday, September 29, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 2-[3-(3-bromopropyl)phenoxy]acetic acid
CAS Name: 2-[3-(3-bromopropyl)phenoxy]acetic acid
IUPAC NAME: 2-[3-(3-bromopropyl)phenoxy]acetic acid
SYSTEMATIC NAME: 2-[3-(3-bromanylpropyl)phenoxy]ethanoic acid
MOLECULAR FORMULA: C11H13BrO3
MOLECULAR WEIGHT: 273.12312
SMILES: C1=CC(=CC(=C1)OCC(=O)O)CCCBr
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Product OPENEYE NAME: 2-[3-(4-benzhydryloxy-4-oxo-butyl)phenoxy]acetate
CAS Name: 2-[3-[4-(diphenylmethyl)oxy-4-oxobutyl]phenoxy]acetate
IUPAC NAME: 2-[3-(4-benzhydryloxy-4-oxobutyl)phenoxy]acetate
SYSTEMATIC NAME: 2-[3-[4-(diphenylmethyl)oxy-4-oxidanylidene-butyl]phenoxy]ethanoate
MOLECULAR FORMULA: C25H23O5-
MOLECULAR WEIGHT: 403.44712
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)CCCC3=CC(=CC=C3)OCC(=O)[O-]
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Product OPENEYE NAME: 2-phenoxy-5-[(Z)-[phenyl(3-pyridyl)methylene]amino]oxy-pentanoic acid
CAS Name: 2-phenoxy-5-[(Z)-[phenyl(3-pyridinyl)methylidene]amino]oxypentanoic acid
IUPAC NAME: 2-phenoxy-5-[(Z)-[phenyl(pyridin-3-yl)methylidene]amino]oxypentanoic acid
SYSTEMATIC NAME: 2-phenoxy-5-[(Z)-[phenyl(pyridin-3-yl)methylidene]amino]oxy-pentanoic acid
MOLECULAR FORMULA: C23H22N2O4
MOLECULAR WEIGHT: 390.43178
SMILES: C1=CC=C(C=C1)/C(=N/OCCCC(C(=O)O)OC2=CC=CC=C2)/C3=CN=CC=C3
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Product OPENEYE NAME: (4E)-4-(diphenylcarbamoylhydrazono)-2-phenoxy-butanoic acid
CAS Name: (4E)-4-[[oxo-(N-phenylanilino)methyl]hydrazinylidene]-2-phenoxybutanoic acid
IUPAC NAME: (4E)-4-(diphenylcarbamoylhydrazinylidene)-2-phenoxybutanoic acid
SYSTEMATIC NAME: (4E)-4-(diphenylcarbamoylhydrazinylidene)-2-phenoxy-butanoic acid
MOLECULAR FORMULA: C23H21N3O4
MOLECULAR WEIGHT: 403.43054
SMILES: C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)N/N=C/CC(C(=O)O)OC3=CC=CC=C3
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Product OPENEYE NAME: 2-[3-(4-benzhydryloxybutyl)phenoxy]acetate
CAS Name: 2-[3-[4-(diphenylmethyl)oxybutyl]phenoxy]acetate
IUPAC NAME: 2-[3-(4-benzhydryloxybutyl)phenoxy]acetate
SYSTEMATIC NAME: 2-[3-[4-(diphenylmethyl)oxybutyl]phenoxy]ethanoate
MOLECULAR FORMULA: C25H25O4-
MOLECULAR WEIGHT: 389.4636
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)OCCCCC3=CC(=CC=C3)OCC(=O)[O-]
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Product OPENEYE NAME: 6-(dibenzylamino)-6-oxo-2-phenoxy-hexanoic acid
CAS Name: 6-[bis(phenylmethyl)amino]-6-oxo-2-phenoxyhexanoic acid
IUPAC NAME: 6-(dibenzylamino)-6-oxo-2-phenoxyhexanoic acid
SYSTEMATIC NAME: 6-[bis(phenylmethyl)amino]-6-oxidanylidene-2-phenoxy-hexanoic acid
MOLECULAR FORMULA: C26H27NO4
MOLECULAR WEIGHT: 417.49688
SMILES: C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)CCCC(C(=O)O)OC3=CC=CC=C3
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Product OPENEYE NAME: 2-[(benzhydrylideneamino)carbamoyl]-2-phenoxy-pentanoic acid
CAS Name: 2-[[2-(diphenylmethylene)hydrazinyl]-oxomethyl]-2-phenoxypentanoic acid
IUPAC NAME: 2-[(benzhydrylideneamino)carbamoyl]-2-phenoxypentanoic acid
SYSTEMATIC NAME: 2-[[(diphenylmethylidene)amino]carbamoyl]-2-phenoxy-pentanoic acid
MOLECULAR FORMULA: C25H24N2O4
MOLECULAR WEIGHT: 416.46906
SMILES: CCCC(C(=O)NN=C(C1=CC=CC=C1)C2=CC=CC=C2)(C(=O)O)OC3=CC=CC=C3
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Product OPENEYE NAME: 4-(2,2-diphenylhydrazino)-4-oxo-2-phenoxy-butanoic acid
CAS Name: 4-(2,2-diphenylhydrazinyl)-4-oxo-2-phenoxybutanoic acid
IUPAC NAME: 4-(2,2-diphenylhydrazinyl)-4-oxo-2-phenoxybutanoic acid
SYSTEMATIC NAME: 4-(2,2-diphenylhydrazinyl)-4-oxidanylidene-2-phenoxy-butanoic acid
MOLECULAR FORMULA: C22H20N2O4
MOLECULAR WEIGHT: 376.4052
SMILES: C1=CC=C(C=C1)N(C2=CC=CC=C2)NC(=O)CC(C(=O)O)OC3=CC=CC=C3
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Product OPENEYE NAME: 5-(4,5-diphenyl-1H-imidazol-2-yl)-2-phenoxy-pentanoic acid
CAS Name: 5-(4,5-diphenyl-1H-imidazol-2-yl)-2-phenoxypentanoic acid
IUPAC NAME: 5-(4,5-diphenyl-1H-imidazol-2-yl)-2-phenoxypentanoic acid
SYSTEMATIC NAME: 5-(4,5-diphenyl-1H-imidazol-2-yl)-2-phenoxy-pentanoic acid
MOLECULAR FORMULA: C26H24N2O3
MOLECULAR WEIGHT: 412.48036
SMILES: C1=CC=C(C=C1)C2=C(N=C(N2)CCCC(C(=O)O)OC3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: 5-oxazol-2-yl-2-phenoxy-pentanoic acid
CAS Name: 5-(2-oxazolyl)-2-phenoxypentanoic acid
IUPAC NAME: 5-(1,3-oxazol-2-yl)-2-phenoxypentanoic acid
SYSTEMATIC NAME: 5-(1,3-oxazol-2-yl)-2-phenoxy-pentanoic acid
MOLECULAR FORMULA: C14H15NO4
MOLECULAR WEIGHT: 261.2732
SMILES: C1=CC=C(C=C1)OC(CCCC2=NC=CO2)C(=O)O
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Product OPENEYE NAME: 2-[3-[(4Z)-4-benzhydryloxyiminoheptyl]phenoxy]acetate
CAS Name: 2-[3-[(4Z)-4-(diphenylmethyl)oxyiminoheptyl]phenoxy]acetate
IUPAC NAME: 2-[3-[(4Z)-4-benzhydryloxyiminoheptyl]phenoxy]acetate
SYSTEMATIC NAME: 2-[3-[(4Z)-4-(diphenylmethyl)oxyiminoheptyl]phenoxy]ethanoate
MOLECULAR FORMULA: C28H30NO4-
MOLECULAR WEIGHT: 444.5421
SMILES: CCC/C(=N/OC(C1=CC=CC=C1)C2=CC=CC=C2)/CCCC3=CC(=CC=C3)OCC(=O)[O-]
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Product OPENEYE NAME: 4-acetamido-2-phenoxy-butanoic acid; N-phenylaniline
CAS Name: 4-acetamido-2-phenoxybutanoic acid; N-phenylaniline
IUPAC NAME: 4-acetamido-2-phenoxybutanoic acid; N-phenylaniline
SYSTEMATIC NAME: 4-acetamido-2-phenoxy-butanoic acid; N-phenylaniline
MOLECULAR FORMULA: C24H26N2O4
MOLECULAR WEIGHT: 406.47424
SMILES: CC(=O)NCCC(C(=O)O)OC1=CC=CC=C1.C1=CC=C(C=C1)NC2=CC=CC=C2
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Product OPENEYE NAME: 4-acetamido-2-phenoxy-butanoic acid
CAS Name: 4-acetamido-2-phenoxybutanoic acid
IUPAC NAME: 4-acetamido-2-phenoxybutanoic acid
SYSTEMATIC NAME: 4-acetamido-2-phenoxy-butanoic acid
MOLECULAR FORMULA: C12H15NO4
MOLECULAR WEIGHT: 237.2518
SMILES: CC(=O)NCCC(C(=O)O)OC1=CC=CC=C1
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Product OPENEYE NAME: 6-(3,3-diphenylpropylamino)-6-oxo-2-phenoxy-hexanoic acid
CAS Name: 6-(3,3-diphenylpropylamino)-6-oxo-2-phenoxyhexanoic acid
IUPAC NAME: 6-(3,3-diphenylpropylamino)-6-oxo-2-phenoxyhexanoic acid
SYSTEMATIC NAME: 6-(3,3-diphenylpropylamino)-6-oxidanylidene-2-phenoxy-hexanoic acid
MOLECULAR FORMULA: C27H29NO4
MOLECULAR WEIGHT: 431.52346
SMILES: C1=CC=C(C=C1)C(CCNC(=O)CCCC(C(=O)O)OC2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: 5-(3-benzhydryl-1,2,4-oxadiazol-5-yl)-2-phenoxy-pentanoic acid
CAS Name: 5-[3-(diphenylmethyl)-1,2,4-oxadiazol-5-yl]-2-phenoxypentanoic acid
IUPAC NAME: 5-(3-benzhydryl-1,2,4-oxadiazol-5-yl)-2-phenoxypentanoic acid
SYSTEMATIC NAME: 5-[3-(diphenylmethyl)-1,2,4-oxadiazol-5-yl]-2-phenoxy-pentanoic acid
MOLECULAR FORMULA: C26H24N2O4
MOLECULAR WEIGHT: 428.47976
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=NOC(=N3)CCCC(C(=O)O)OC4=CC=CC=C4
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Product OPENEYE NAME: 1-phenyl-1-(2-tetrahydropyran-2-yloxyethoxy)propan-1-ol
CAS Name: 1-[2-(2-oxanyloxy)ethoxy]-1-phenyl-1-propanol
IUPAC NAME: 1-[2-(oxan-2-yloxy)ethoxy]-1-phenylpropan-1-ol
SYSTEMATIC NAME: 1-[2-(oxan-2-yloxy)ethoxy]-1-phenyl-propan-1-ol
MOLECULAR FORMULA: C16H24O4
MOLECULAR WEIGHT: 280.35936
SMILES: CCC(C1=CC=CC=C1)(O)OCCOC2CCCCO2
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Product OPENEYE NAME: 4-(2-benzhydrylidenehydrazino)-4-oxo-2-phenoxy-butanoic acid
CAS Name: 4-[2-(diphenylmethylene)hydrazinyl]-4-oxo-2-phenoxybutanoic acid
IUPAC NAME: 4-(2-benzhydrylidenehydrazinyl)-4-oxo-2-phenoxybutanoic acid
SYSTEMATIC NAME: 4-[2-(diphenylmethylidene)hydrazinyl]-4-oxidanylidene-2-phenoxy-butanoic acid
MOLECULAR FORMULA: C23H20N2O4
MOLECULAR WEIGHT: 388.4159
SMILES: C1=CC=C(C=C1)C(=NNC(=O)CC(C(=O)O)OC2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: (3Z)-2-cyclohexyl-2-phenoxy-3-(2-phenylethoxyimino)butanoic acid
CAS Name: (3Z)-2-cyclohexyl-2-phenoxy-3-(2-phenylethoxyimino)butanoic acid
IUPAC NAME: (3Z)-2-cyclohexyl-2-phenoxy-3-(2-phenylethoxyimino)butanoic acid
SYSTEMATIC NAME: (3Z)-2-cyclohexyl-2-phenoxy-3-(2-phenylethoxyimino)butanoic acid
MOLECULAR FORMULA: C24H29NO4
MOLECULAR WEIGHT: 395.49136
SMILES: C/C(=N/OCCC1=CC=CC=C1)/C(C2CCCCC2)(C(=O)O)OC3=CC=CC=C3
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Product OPENEYE NAME: 5-(2-benzhydryl-1H-imidazol-5-yl)-2-phenoxy-pentanoic acid
CAS Name: 5-[2-(diphenylmethyl)-1H-imidazol-5-yl]-2-phenoxypentanoic acid
IUPAC NAME: 5-(2-benzhydryl-1H-imidazol-5-yl)-2-phenoxypentanoic acid
SYSTEMATIC NAME: 5-[2-(diphenylmethyl)-1H-imidazol-5-yl]-2-phenoxy-pentanoic acid
MOLECULAR FORMULA: C27H26N2O3
MOLECULAR WEIGHT: 426.50694
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=NC=C(N3)CCCC(C(=O)O)OC4=CC=CC=C4
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Product OPENEYE NAME: 5-(3,3-diphenylpropylamino)-5-oxo-2-phenoxy-pentanoic acid
CAS Name: 5-(3,3-diphenylpropylamino)-5-oxo-2-phenoxypentanoic acid
IUPAC NAME: 5-(3,3-diphenylpropylamino)-5-oxo-2-phenoxypentanoic acid
SYSTEMATIC NAME: 5-(3,3-diphenylpropylamino)-5-oxidanylidene-2-phenoxy-pentanoic acid
MOLECULAR FORMULA: C26H27NO4
MOLECULAR WEIGHT: 417.49688
SMILES: C1=CC=C(C=C1)C(CCNC(=O)CCC(C(=O)O)OC2=CC=CC=C2)C3=CC=CC=C3
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