Wednesday, September 26, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 3-chloro-2-(2-hydroxybutoxy)benzamide
CAS Name: 3-chloro-2-(2-hydroxybutoxy)benzamide
IUPAC NAME: 3-chloro-2-(2-hydroxybutoxy)benzamide
SYSTEMATIC NAME: 3-chloranyl-2-(2-oxidanylbutoxy)benzamide
MOLECULAR FORMULA: C11H14ClNO3
MOLECULAR WEIGHT: 243.68676
SMILES: CCC(COC1=C(C=CC=C1Cl)C(=O)N)O
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Product OPENEYE NAME: 2-oxo-2-sec-butoxy-acetate
CAS Name: 2-butan-2-yloxy-2-oxoacetate
IUPAC NAME: 2-butan-2-yloxy-2-oxoacetate
SYSTEMATIC NAME: 2-butan-2-yloxy-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C6H9O4-
MOLECULAR WEIGHT: 145.13326
SMILES: CCC(C)OC(=O)C(=O)[O-]
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Product OPENEYE NAME: 2-oxo-2-sec-butoxy-acetic acid
CAS Name: 2-butan-2-yloxy-2-oxoacetic acid
IUPAC NAME: 2-butan-2-yloxy-2-oxoacetic acid
SYSTEMATIC NAME: 2-butan-2-yloxy-2-oxidanylidene-ethanoic acid
MOLECULAR FORMULA: C6H10O4
MOLECULAR WEIGHT: 146.1412
SMILES: CCC(C)OC(=O)C(=O)O
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Product OPENEYE NAME: 4-(2-chlorophenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
CAS Name: 4-(2-chlorophenyl)-1-phenoxy-4-(1-piperazinyl)-2-butanol
IUPAC NAME: 4-(2-chlorophenyl)-1-phenoxy-4-piperazin-1-ylbutan-2-ol
SYSTEMATIC NAME: 4-(2-chlorophenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
MOLECULAR FORMULA: C20H25ClN2O2
MOLECULAR WEIGHT: 360.8777
SMILES: C1CN(CCN1)C(CC(COC2=CC=CC=C2)O)C3=CC=CC=C3Cl
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Product OPENEYE NAME: 4-(3-chlorophenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
CAS Name: 4-(3-chlorophenyl)-1-phenoxy-4-(1-piperazinyl)-2-butanol
IUPAC NAME: 4-(3-chlorophenyl)-1-phenoxy-4-piperazin-1-ylbutan-2-ol
SYSTEMATIC NAME: 4-(3-chlorophenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
MOLECULAR FORMULA: C20H25ClN2O2
MOLECULAR WEIGHT: 360.8777
SMILES: C1CN(CCN1)C(CC(COC2=CC=CC=C2)O)C3=CC(=CC=C3)Cl
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Product OPENEYE NAME: 1-(3,5-dimethylphenoxy)-4-(4-fluorophenyl)-4-piperazin-1-yl-butan-2-ol hydrate hydrochloride
CAS Name: 1-(3,5-dimethylphenoxy)-4-(4-fluorophenyl)-4-(1-piperazinyl)-2-butanol hydrate hydrochloride
IUPAC NAME: 1-(3,5-dimethylphenoxy)-4-(4-fluorophenyl)-4-piperazin-1-ylbutan-2-ol hydrate hydrochloride
SYSTEMATIC NAME: 1-(3,5-dimethylphenoxy)-4-(4-fluorophenyl)-4-piperazin-1-yl-butan-2-ol hydrate hydrochloride
MOLECULAR FORMULA: C22H32ClFN2O3
MOLECULAR WEIGHT: 426.952483
SMILES: CC1=CC(=CC(=C1)OCC(CC(C2=CC=C(C=C2)F)N3CCNCC3)O)C.O.Cl
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Product OPENEYE NAME: 1-(3,5-dimethylphenoxy)-4-(4-fluorophenyl)-4-piperazin-1-yl-butan-2-ol
CAS Name: 1-(3,5-dimethylphenoxy)-4-(4-fluorophenyl)-4-(1-piperazinyl)-2-butanol
IUPAC NAME: 1-(3,5-dimethylphenoxy)-4-(4-fluorophenyl)-4-piperazin-1-ylbutan-2-ol
SYSTEMATIC NAME: 1-(3,5-dimethylphenoxy)-4-(4-fluorophenyl)-4-piperazin-1-yl-butan-2-ol
MOLECULAR FORMULA: C22H29FN2O2
MOLECULAR WEIGHT: 372.476263
SMILES: CC1=CC(=CC(=C1)OCC(CC(C2=CC=C(C=C2)F)N3CCNCC3)O)C
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Product OPENEYE NAME: 4-(4-methoxyphenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
CAS Name: 4-(4-methoxyphenyl)-1-phenoxy-4-(1-piperazinyl)-2-butanol
IUPAC NAME: 4-(4-methoxyphenyl)-1-phenoxy-4-piperazin-1-ylbutan-2-ol
SYSTEMATIC NAME: 4-(4-methoxyphenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
MOLECULAR FORMULA: C21H28N2O3
MOLECULAR WEIGHT: 356.45862
SMILES: COC1=CC=C(C=C1)C(CC(COC2=CC=CC=C2)O)N3CCNCC3
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Product OPENEYE NAME: 1-(4-bromo-2,6-dimethyl-phenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol; oxalic acid
CAS Name: 1-(4-bromo-2,6-dimethylphenoxy)-4-(1-piperazinyl)-4-(3,4,5-trimethoxyphenyl)-2-butanol; oxalic acid
IUPAC NAME: 1-(4-bromo-2,6-dimethylphenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol; oxalic acid
SYSTEMATIC NAME: 1-(4-bromanyl-2,6-dimethyl-phenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol; ethanedioic acid
MOLECULAR FORMULA: C27H37BrN2O9
MOLECULAR WEIGHT: 613.49468
SMILES: CC1=CC(=CC(=C1OCC(CC(C2=CC(=C(C(=C2)OC)OC)OC)N3CCNCC3)O)C)Br.C(=O)(C(=O)O)O
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Product OPENEYE NAME: 1-(4-bromo-2,6-dimethyl-phenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol
CAS Name: 1-(4-bromo-2,6-dimethylphenoxy)-4-(1-piperazinyl)-4-(3,4,5-trimethoxyphenyl)-2-butanol
IUPAC NAME: 1-(4-bromo-2,6-dimethylphenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol
SYSTEMATIC NAME: 1-(4-bromanyl-2,6-dimethyl-phenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol
MOLECULAR FORMULA: C25H35BrN2O5
MOLECULAR WEIGHT: 523.4598
SMILES: CC1=CC(=CC(=C1OCC(CC(C2=CC(=C(C(=C2)OC)OC)OC)N3CCNCC3)O)C)Br
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Product OPENEYE NAME: 1-(4-chloro-3-methyl-phenoxy)-4-piperazin-1-yl-4-(2-pyridyl)butan-2-ol dihydrochloride
CAS Name: 1-(4-chloro-3-methylphenoxy)-4-(1-piperazinyl)-4-(2-pyridinyl)-2-butanol dihydrochloride
IUPAC NAME: 1-(4-chloro-3-methylphenoxy)-4-piperazin-1-yl-4-pyridin-2-ylbutan-2-ol dihydrochloride
SYSTEMATIC NAME: 1-(4-chloranyl-3-methyl-phenoxy)-4-piperazin-1-yl-4-pyridin-2-yl-butan-2-ol dihydrochloride
MOLECULAR FORMULA: C20H28Cl3N3O2
MOLECULAR WEIGHT: 448.81422
SMILES: CC1=C(C=CC(=C1)OCC(CC(C2=CC=CC=N2)N3CCNCC3)O)Cl.Cl.Cl
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Product OPENEYE NAME: 1-(4-chloro-3-methyl-phenoxy)-4-piperazin-1-yl-4-(2-pyridyl)butan-2-ol
CAS Name: 1-(4-chloro-3-methylphenoxy)-4-(1-piperazinyl)-4-(2-pyridinyl)-2-butanol
IUPAC NAME: 1-(4-chloro-3-methylphenoxy)-4-piperazin-1-yl-4-pyridin-2-ylbutan-2-ol
SYSTEMATIC NAME: 1-(4-chloranyl-3-methyl-phenoxy)-4-piperazin-1-yl-4-pyridin-2-yl-butan-2-ol
MOLECULAR FORMULA: C20H26ClN3O2
MOLECULAR WEIGHT: 375.89234
SMILES: CC1=C(C=CC(=C1)OCC(CC(C2=CC=CC=N2)N3CCNCC3)O)Cl
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Product OPENEYE NAME: 4-(4-chlorophenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
CAS Name: 4-(4-chlorophenyl)-1-phenoxy-4-(1-piperazinyl)-2-butanol
IUPAC NAME: 4-(4-chlorophenyl)-1-phenoxy-4-piperazin-1-ylbutan-2-ol
SYSTEMATIC NAME: 4-(4-chlorophenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
MOLECULAR FORMULA: C20H25ClN2O2
MOLECULAR WEIGHT: 360.8777
SMILES: C1CN(CCN1)C(CC(COC2=CC=CC=C2)O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 4-(3-hydroxy-4-phenoxy-1-piperazin-1-yl-butyl)benzoic acid
CAS Name: 4-[3-hydroxy-4-phenoxy-1-(1-piperazinyl)butyl]benzoic acid
IUPAC NAME: 4-(3-hydroxy-4-phenoxy-1-piperazin-1-ylbutyl)benzoic acid
SYSTEMATIC NAME: 4-(3-oxidanyl-4-phenoxy-1-piperazin-1-yl-butyl)benzoic acid
MOLECULAR FORMULA: C21H26N2O4
MOLECULAR WEIGHT: 370.44214
SMILES: C1CN(CCN1)C(CC(COC2=CC=CC=C2)O)C3=CC=C(C=C3)C(=O)O
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Product OPENEYE NAME: 4-(4-fluorophenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
CAS Name: 4-(4-fluorophenyl)-1-phenoxy-4-(1-piperazinyl)-2-butanol
IUPAC NAME: 4-(4-fluorophenyl)-1-phenoxy-4-piperazin-1-ylbutan-2-ol
SYSTEMATIC NAME: 4-(4-fluorophenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
MOLECULAR FORMULA: C20H25FN2O2
MOLECULAR WEIGHT: 344.423103
SMILES: C1CN(CCN1)C(CC(COC2=CC=CC=C2)O)C3=CC=C(C=C3)F
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Product OPENEYE NAME: 4-(3,4-dichlorophenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
CAS Name: 4-(3,4-dichlorophenyl)-1-phenoxy-4-(1-piperazinyl)-2-butanol
IUPAC NAME: 4-(3,4-dichlorophenyl)-1-phenoxy-4-piperazin-1-ylbutan-2-ol
SYSTEMATIC NAME: 4-(3,4-dichlorophenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
MOLECULAR FORMULA: C20H24Cl2N2O2
MOLECULAR WEIGHT: 395.32276
SMILES: C1CN(CCN1)C(CC(COC2=CC=CC=C2)O)C3=CC(=C(C=C3)Cl)Cl
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Product OPENEYE NAME: 4-hydroxy-5-phenoxy-2-piperazin-1-yl-pentanamide
CAS Name: 4-hydroxy-5-phenoxy-2-(1-piperazinyl)pentanamide
IUPAC NAME: 4-hydroxy-5-phenoxy-2-piperazin-1-ylpentanamide
SYSTEMATIC NAME: 4-oxidanyl-5-phenoxy-2-piperazin-1-yl-pentanamide
MOLECULAR FORMULA: C15H23N3O3
MOLECULAR WEIGHT: 293.36142
SMILES: C1CN(CCN1)C(CC(COC2=CC=CC=C2)O)C(=O)N
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Product OPENEYE NAME: 1-[4-[4-(4-chlorophenoxy)-3-hydroxy-1-piperazin-1-yl-butyl]phenyl]ethanone
CAS Name: 1-[4-[4-(4-chlorophenoxy)-3-hydroxy-1-(1-piperazinyl)butyl]phenyl]ethanone
IUPAC NAME: 1-[4-[4-(4-chlorophenoxy)-3-hydroxy-1-piperazin-1-ylbutyl]phenyl]ethanone
SYSTEMATIC NAME: 1-[4-[4-(4-chloranylphenoxy)-3-oxidanyl-1-piperazin-1-yl-butyl]phenyl]ethanone
MOLECULAR FORMULA: C22H27ClN2O3
MOLECULAR WEIGHT: 402.91438
SMILES: CC(=O)C1=CC=C(C=C1)C(CC(COC2=CC=C(C=C2)Cl)O)N3CCNCC3
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Product OPENEYE NAME: 1-(4-chloro-3,5-dimethyl-phenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol; oxalic acid
CAS Name: 1-(4-chloro-3,5-dimethylphenoxy)-4-(1-piperazinyl)-4-(3,4,5-trimethoxyphenyl)-2-butanol; oxalic acid
IUPAC NAME: 1-(4-chloro-3,5-dimethylphenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol; oxalic acid
SYSTEMATIC NAME: 1-(4-chloranyl-3,5-dimethyl-phenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol; ethanedioic acid
MOLECULAR FORMULA: C27H37ClN2O9
MOLECULAR WEIGHT: 569.04368
SMILES: CC1=CC(=CC(=C1Cl)C)OCC(CC(C2=CC(=C(C(=C2)OC)OC)OC)N3CCNCC3)O.C(=O)(C(=O)O)O
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