Wednesday, September 26, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 4-piperazin-1-yl-4-(2-pyridyl)-1-[3-(trifluoromethyl)phenoxy]butan-2-ol
CAS Name: 4-(1-piperazinyl)-4-(2-pyridinyl)-1-[3-(trifluoromethyl)phenoxy]-2-butanol
IUPAC NAME: 4-piperazin-1-yl-4-pyridin-2-yl-1-[3-(trifluoromethyl)phenoxy]butan-2-ol
SYSTEMATIC NAME: 4-piperazin-1-yl-4-pyridin-2-yl-1-[3-(trifluoromethyl)phenoxy]butan-2-ol
MOLECULAR FORMULA: C20H24F3N3O2
MOLECULAR WEIGHT: 395.41867
SMILES: C1CN(CCN1)C(CC(COC2=CC=CC(=C2)C(F)(F)F)O)C3=CC=CC=N3
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Product OPENEYE NAME: 4-(4-aminophenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
CAS Name: 4-(4-aminophenyl)-1-phenoxy-4-(1-piperazinyl)-2-butanol
IUPAC NAME: 4-(4-aminophenyl)-1-phenoxy-4-piperazin-1-ylbutan-2-ol
SYSTEMATIC NAME: 4-(4-aminophenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
MOLECULAR FORMULA: C20H27N3O2
MOLECULAR WEIGHT: 341.44728
SMILES: C1CN(CCN1)C(CC(COC2=CC=CC=C2)O)C3=CC=C(C=C3)N
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Product OPENEYE NAME: 4-(2-methoxyphenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
CAS Name: 4-(2-methoxyphenyl)-1-phenoxy-4-(1-piperazinyl)-2-butanol
IUPAC NAME: 4-(2-methoxyphenyl)-1-phenoxy-4-piperazin-1-ylbutan-2-ol
SYSTEMATIC NAME: 4-(2-methoxyphenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
MOLECULAR FORMULA: C21H28N2O3
MOLECULAR WEIGHT: 356.45862
SMILES: COC1=CC=CC=C1C(CC(COC2=CC=CC=C2)O)N3CCNCC3
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Product OPENEYE NAME: 1-(4-fluorophenoxy)butan-2-ol
CAS Name: 1-(4-fluorophenoxy)-2-butanol
IUPAC NAME: 1-(4-fluorophenoxy)butan-2-ol
SYSTEMATIC NAME: 1-(4-fluoranylphenoxy)butan-2-ol
MOLECULAR FORMULA: C10H13FO2
MOLECULAR WEIGHT: 184.207423
SMILES: CCC(COC1=CC=C(C=C1)F)O
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Product OPENEYE NAME: 4-(3-methoxyphenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
CAS Name: 4-(3-methoxyphenyl)-1-phenoxy-4-(1-piperazinyl)-2-butanol
IUPAC NAME: 4-(3-methoxyphenyl)-1-phenoxy-4-piperazin-1-ylbutan-2-ol
SYSTEMATIC NAME: 4-(3-methoxyphenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
MOLECULAR FORMULA: C21H28N2O3
MOLECULAR WEIGHT: 356.45862
SMILES: COC1=CC=CC(=C1)C(CC(COC2=CC=CC=C2)O)N3CCNCC3
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Product OPENEYE NAME: 1-[4-(3-hydroxy-4-phenoxy-1-piperazin-1-yl-butyl)phenyl]ethanone
CAS Name: 1-[4-[3-hydroxy-4-phenoxy-1-(1-piperazinyl)butyl]phenyl]ethanone
IUPAC NAME: 1-[4-(3-hydroxy-4-phenoxy-1-piperazin-1-ylbutyl)phenyl]ethanone
SYSTEMATIC NAME: 1-[4-(3-oxidanyl-4-phenoxy-1-piperazin-1-yl-butyl)phenyl]ethanone
MOLECULAR FORMULA: C22H28N2O3
MOLECULAR WEIGHT: 368.46932
SMILES: CC(=O)C1=CC=C(C=C1)C(CC(COC2=CC=CC=C2)O)N3CCNCC3
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Product OPENEYE NAME: 1-(2,4-dichloro-6-nitro-phenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol; oxalic acid
CAS Name: 1-(2,4-dichloro-6-nitrophenoxy)-4-(1-piperazinyl)-4-(3,4,5-trimethoxyphenyl)-2-butanol; oxalic acid
IUPAC NAME: 1-(2,4-dichloro-6-nitrophenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol; oxalic acid
SYSTEMATIC NAME: 1-[2,4-bis(chloranyl)-6-nitro-phenoxy]-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol; ethanedioic acid
MOLECULAR FORMULA: C25H31Cl2N3O11
MOLECULAR WEIGHT: 620.43314
SMILES: COC1=CC(=CC(=C1OC)OC)C(CC(COC2=C(C=C(C=C2[N+](=O)[O-])Cl)Cl)O)N3CCNCC3.C(=O)(C(=O)O)O
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Product OPENEYE NAME: 1-(2,4-dichloro-6-nitro-phenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol
CAS Name: 1-(2,4-dichloro-6-nitrophenoxy)-4-(1-piperazinyl)-4-(3,4,5-trimethoxyphenyl)-2-butanol
IUPAC NAME: 1-(2,4-dichloro-6-nitrophenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol
SYSTEMATIC NAME: 1-[2,4-bis(chloranyl)-6-nitro-phenoxy]-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol
MOLECULAR FORMULA: C23H29Cl2N3O7
MOLECULAR WEIGHT: 530.39826
SMILES: COC1=CC(=CC(=C1OC)OC)C(CC(COC2=C(C=C(C=C2[N+](=O)[O-])Cl)Cl)O)N3CCNCC3
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Product OPENEYE NAME: 4-(4-nitrophenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
CAS Name: 4-(4-nitrophenyl)-1-phenoxy-4-(1-piperazinyl)-2-butanol
IUPAC NAME: 4-(4-nitrophenyl)-1-phenoxy-4-piperazin-1-ylbutan-2-ol
SYSTEMATIC NAME: 4-(4-nitrophenyl)-1-phenoxy-4-piperazin-1-yl-butan-2-ol
MOLECULAR FORMULA: C20H25N3O4
MOLECULAR WEIGHT: 371.4302
SMILES: C1CN(CCN1)C(CC(COC2=CC=CC=C2)O)C3=CC=C(C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: 1-(4-chloro-3-methyl-phenoxy)butan-2-ol
CAS Name: 1-(4-chloro-3-methylphenoxy)-2-butanol
IUPAC NAME: 1-(4-chloro-3-methylphenoxy)butan-2-ol
SYSTEMATIC NAME: 1-(4-chloranyl-3-methyl-phenoxy)butan-2-ol
MOLECULAR FORMULA: C11H15ClO2
MOLECULAR WEIGHT: 214.6886
SMILES: CCC(COC1=CC(=C(C=C1)Cl)C)O
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Product OPENEYE NAME: 1-(2-chloro-4,5-dimethyl-phenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol; oxalic acid
CAS Name: 1-(2-chloro-4,5-dimethylphenoxy)-4-(1-piperazinyl)-4-(3,4,5-trimethoxyphenyl)-2-butanol; oxalic acid
IUPAC NAME: 1-(2-chloro-4,5-dimethylphenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol; oxalic acid
SYSTEMATIC NAME: 1-(2-chloranyl-4,5-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(=C(C=C1C)Cl)OCC(CC(C2=CC(=C(C(=C2)OC)OC)OC)N3CCNCC3)O.C(=O)(C(=O)O)O
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Product OPENEYE NAME: 1-(2-chloro-4,5-dimethyl-phenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol
CAS Name: 1-(2-chloro-4,5-dimethylphenoxy)-4-(1-piperazinyl)-4-(3,4,5-trimethoxyphenyl)-2-butanol
IUPAC NAME: 1-(2-chloro-4,5-dimethylphenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol
SYSTEMATIC NAME: 1-(2-chloranyl-4,5-dimethyl-phenoxy)-4-piperazin-1-yl-4-(3,4,5-trimethoxyphenyl)butan-2-ol
MOLECULAR FORMULA: C25H35ClN2O5
MOLECULAR WEIGHT: 479.0088
SMILES: CC1=CC(=C(C=C1C)Cl)OCC(CC(C2=CC(=C(C(=C2)OC)OC)OC)N3CCNCC3)O
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Product OPENEYE NAME: 4-(2-hydroxybutoxy)benzonitrile
CAS Name: 4-(2-hydroxybutoxy)benzonitrile
IUPAC NAME: 4-(2-hydroxybutoxy)benzonitrile
SYSTEMATIC NAME: 4-(2-oxidanylbutoxy)benzenecarbonitrile
MOLECULAR FORMULA: C11H13NO2
MOLECULAR WEIGHT: 191.22642
SMILES: CCC(COC1=CC=C(C=C1)C#N)O
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Product OPENEYE NAME: N-[4-[4-(4-chlorophenyl)-2-hydroxy-4-piperazin-1-yl-butoxy]phenyl]acetamide hydrochloride
CAS Name: N-[4-[4-(4-chlorophenyl)-2-hydroxy-4-(1-piperazinyl)butoxy]phenyl]acetamide hydrochloride
IUPAC NAME: N-[4-[4-(4-chlorophenyl)-2-hydroxy-4-piperazin-1-ylbutoxy]phenyl]acetamide hydrochloride
SYSTEMATIC NAME: N-[4-[4-(4-chlorophenyl)-2-oxidanyl-4-piperazin-1-yl-butoxy]phenyl]ethanamide hydrochloride
MOLECULAR FORMULA: C22H29Cl2N3O3
MOLECULAR WEIGHT: 454.38996
SMILES: CC(=O)NC1=CC=C(C=C1)OCC(CC(C2=CC=C(C=C2)Cl)N3CCNCC3)O.Cl
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Product OPENEYE NAME: N-[4-[4-(4-chlorophenyl)-2-hydroxy-4-piperazin-1-yl-butoxy]phenyl]acetamide
CAS Name: N-[4-[4-(4-chlorophenyl)-2-hydroxy-4-(1-piperazinyl)butoxy]phenyl]acetamide
IUPAC NAME: N-[4-[4-(4-chlorophenyl)-2-hydroxy-4-piperazin-1-ylbutoxy]phenyl]acetamide
SYSTEMATIC NAME: N-[4-[4-(4-chlorophenyl)-2-oxidanyl-4-piperazin-1-yl-butoxy]phenyl]ethanamide
MOLECULAR FORMULA: C22H28ClN3O3
MOLECULAR WEIGHT: 417.92902
SMILES: CC(=O)NC1=CC=C(C=C1)OCC(CC(C2=CC=C(C=C2)Cl)N3CCNCC3)O
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Product OPENEYE NAME: butan-2-ol hydrate trihydrochloride
CAS Name: 2-butanol hydrate trihydrochloride
IUPAC NAME: butan-2-ol hydrate trihydrochloride
SYSTEMATIC NAME: butan-2-ol hydrate trihydrochloride
MOLECULAR FORMULA: C4H15Cl3O2
MOLECULAR WEIGHT: 201.5197
SMILES: CCC(C)O.O.Cl.Cl.Cl
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Product OPENEYE NAME: ethyl 4-(3-hydroxy-4-phenoxy-1-piperazin-1-yl-butyl)benzoate
CAS Name: 4-[3-hydroxy-4-phenoxy-1-(1-piperazinyl)butyl]benzoic acid ethyl ester
IUPAC NAME: ethyl 4-(3-hydroxy-4-phenoxy-1-piperazin-1-ylbutyl)benzoate
SYSTEMATIC NAME: ethyl 4-(3-oxidanyl-4-phenoxy-1-piperazin-1-yl-butyl)benzoate
MOLECULAR FORMULA: C23H30N2O4
MOLECULAR WEIGHT: 398.4953
SMILES: CCOC(=O)C1=CC=C(C=C1)C(CC(COC2=CC=CC=C2)O)N3CCNCC3
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Product OPENEYE NAME: 1-(3,4-dichlorophenoxy)butan-2-ol
CAS Name: 1-(3,4-dichlorophenoxy)-2-butanol
IUPAC NAME: 1-(3,4-dichlorophenoxy)butan-2-ol
SYSTEMATIC NAME: 1-[3,4-bis(chloranyl)phenoxy]butan-2-ol
MOLECULAR FORMULA: C10H12Cl2O2
MOLECULAR WEIGHT: 235.10708
SMILES: CCC(COC1=CC(=C(C=C1)Cl)Cl)O
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Product OPENEYE NAME: butan-2-ol hydrochloride
CAS Name: 2-butanol hydrochloride
IUPAC NAME: butan-2-ol hydrochloride
SYSTEMATIC NAME: butan-2-ol hydrochloride
MOLECULAR FORMULA: C4H11ClO
MOLECULAR WEIGHT: 110.58254
SMILES: CCC(C)O.Cl
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