Tuesday, May 7, 2013

All Chemical Compounds Information



Product OPENEYE NAME: 4-[1-[(1-butyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]phenol
CAS Name: 4-[1-[(1-butyl-5-tetrazolyl)methyl]-4-piperidin-1-iumyl]phenol
IUPAC NAME: 4-[1-[(1-butyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]phenol
SYSTEMATIC NAME: 4-[1-[(1-butyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-1-ium-4-yl]phenol
MOLECULAR FORMULA: C17H26N5O+
MOLECULAR WEIGHT: 316.42124
SMILES: CCCCN1C(=NN=N1)C[NH+]2CCC(CC2)C3=CC=C(C=C3)O
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Product OPENEYE NAME: 4-[1-[(1-butyltetrazol-5-yl)methyl]-4-piperidyl]phenol
CAS Name: 4-[1-[(1-butyl-5-tetrazolyl)methyl]-4-piperidinyl]phenol
IUPAC NAME: 4-[1-[(1-butyltetrazol-5-yl)methyl]piperidin-4-yl]phenol
SYSTEMATIC NAME: 4-[1-[(1-butyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-4-yl]phenol
MOLECULAR FORMULA: C17H25N5O
MOLECULAR WEIGHT: 315.4133
SMILES: CCCCN1C(=NN=N1)CN2CCC(CC2)C3=CC=C(C=C3)O
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Product OPENEYE NAME: 4-[1-[(1R)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]piperidin-1-ium-4-yl]phenol
CAS Name: 4-[1-[(1R)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]-4-piperidin-1-iumyl]phenol
IUPAC NAME: 4-[1-[(1R)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]piperidin-1-ium-4-yl]phenol
SYSTEMATIC NAME: 4-[1-[(1R)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]piperidin-1-ium-4-yl]phenol
MOLECULAR FORMULA: C21H24N3O2+
MOLECULAR WEIGHT: 350.43416
SMILES: C[C@H](C1=NN=C(O1)C2=CC=CC=C2)[NH+]3CCC(CC3)C4=CC=C(C=C4)O
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Product OPENEYE NAME: 4-[1-[(1R)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]-4-piperidyl]phenol
CAS Name: 4-[1-[(1R)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]-4-piperidinyl]phenol
IUPAC NAME: 4-[1-[(1R)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]piperidin-4-yl]phenol
SYSTEMATIC NAME: 4-[1-[(1R)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]piperidin-4-yl]phenol
MOLECULAR FORMULA: C21H23N3O2
MOLECULAR WEIGHT: 349.42622
SMILES: C[C@H](C1=NN=C(O1)C2=CC=CC=C2)N3CCC(CC3)C4=CC=C(C=C4)O
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Product OPENEYE NAME: 4-[1-[(1S)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]piperidin-1-ium-4-yl]phenol
CAS Name: 4-[1-[(1S)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]-4-piperidin-1-iumyl]phenol
IUPAC NAME: 4-[1-[(1S)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]piperidin-1-ium-4-yl]phenol
SYSTEMATIC NAME: 4-[1-[(1S)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]piperidin-1-ium-4-yl]phenol
MOLECULAR FORMULA: C21H24N3O2+
MOLECULAR WEIGHT: 350.43416
SMILES: C[C@@H](C1=NN=C(O1)C2=CC=CC=C2)[NH+]3CCC(CC3)C4=CC=C(C=C4)O
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Product OPENEYE NAME: 4-[1-[(1S)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]-4-piperidyl]phenol
CAS Name: 4-[1-[(1S)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]-4-piperidinyl]phenol
IUPAC NAME: 4-[1-[(1S)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]piperidin-4-yl]phenol
SYSTEMATIC NAME: 4-[1-[(1S)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]piperidin-4-yl]phenol
MOLECULAR FORMULA: C21H23N3O2
MOLECULAR WEIGHT: 349.42622
SMILES: C[C@@H](C1=NN=C(O1)C2=CC=CC=C2)N3CCC(CC3)C4=CC=C(C=C4)O
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Product OPENEYE NAME: 4-[1-[(1-propyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]phenol
CAS Name: 4-[1-[(1-propyl-5-tetrazolyl)methyl]-4-piperidin-1-iumyl]phenol
IUPAC NAME: 4-[1-[(1-propyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]phenol
SYSTEMATIC NAME: 4-[1-[(1-propyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-1-ium-4-yl]phenol
MOLECULAR FORMULA: C16H24N5O+
MOLECULAR WEIGHT: 302.39466
SMILES: CCCN1C(=NN=N1)C[NH+]2CCC(CC2)C3=CC=C(C=C3)O
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Product OPENEYE NAME: 4-[1-[(1-propyltetrazol-5-yl)methyl]-4-piperidyl]phenol
CAS Name: 4-[1-[(1-propyl-5-tetrazolyl)methyl]-4-piperidinyl]phenol
IUPAC NAME: 4-[1-[(1-propyltetrazol-5-yl)methyl]piperidin-4-yl]phenol
SYSTEMATIC NAME: 4-[1-[(1-propyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-4-yl]phenol
MOLECULAR FORMULA: C16H23N5O
MOLECULAR WEIGHT: 301.38672
SMILES: CCCN1C(=NN=N1)CN2CCC(CC2)C3=CC=C(C=C3)O
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Product OPENEYE NAME: (2S)-2-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]-N,N-dimethyl-2-phenyl-acetamide
CAS Name: (2S)-2-[4-(4-hydroxyphenyl)-1-piperidin-1-iumyl]-N,N-dimethyl-2-phenylacetamide
IUPAC NAME: (2S)-2-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]-N,N-dimethyl-2-phenylacetamide
SYSTEMATIC NAME: (2S)-2-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]-N,N-dimethyl-2-phenyl-ethanamide
MOLECULAR FORMULA: C21H27N2O2+
MOLECULAR WEIGHT: 339.45128
SMILES: CN(C)C(=O)[C@H](C1=CC=CC=C1)[NH+]2CCC(CC2)C3=CC=C(C=C3)O
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Product OPENEYE NAME: (2S)-2-[4-(4-hydroxyphenyl)-1-piperidyl]-N,N-dimethyl-2-phenyl-acetamide
CAS Name: (2S)-2-[4-(4-hydroxyphenyl)-1-piperidinyl]-N,N-dimethyl-2-phenylacetamide
IUPAC NAME: (2S)-2-[4-(4-hydroxyphenyl)piperidin-1-yl]-N,N-dimethyl-2-phenylacetamide
SYSTEMATIC NAME: (2S)-2-[4-(4-hydroxyphenyl)piperidin-1-yl]-N,N-dimethyl-2-phenyl-ethanamide
MOLECULAR FORMULA: C21H26N2O2
MOLECULAR WEIGHT: 338.44334
SMILES: CN(C)C(=O)[C@H](C1=CC=CC=C1)N2CCC(CC2)C3=CC=C(C=C3)O
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Product OPENEYE NAME: (2R)-2-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]-N,N-dimethyl-2-phenyl-acetamide
CAS Name: (2R)-2-[4-(4-hydroxyphenyl)-1-piperidin-1-iumyl]-N,N-dimethyl-2-phenylacetamide
IUPAC NAME: (2R)-2-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]-N,N-dimethyl-2-phenylacetamide
SYSTEMATIC NAME: (2R)-2-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]-N,N-dimethyl-2-phenyl-ethanamide
MOLECULAR FORMULA: C21H27N2O2+
MOLECULAR WEIGHT: 339.45128
SMILES: CN(C)C(=O)[C@@H](C1=CC=CC=C1)[NH+]2CCC(CC2)C3=CC=C(C=C3)O
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Product OPENEYE NAME: (2R)-2-[4-(4-hydroxyphenyl)-1-piperidyl]-N,N-dimethyl-2-phenyl-acetamide
CAS Name: (2R)-2-[4-(4-hydroxyphenyl)-1-piperidinyl]-N,N-dimethyl-2-phenylacetamide
IUPAC NAME: (2R)-2-[4-(4-hydroxyphenyl)piperidin-1-yl]-N,N-dimethyl-2-phenylacetamide
SYSTEMATIC NAME: (2R)-2-[4-(4-hydroxyphenyl)piperidin-1-yl]-N,N-dimethyl-2-phenyl-ethanamide
MOLECULAR FORMULA: C21H26N2O2
MOLECULAR WEIGHT: 338.44334
SMILES: CN(C)C(=O)[C@@H](C1=CC=CC=C1)N2CCC(CC2)C3=CC=C(C=C3)O
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Product OPENEYE NAME: (2R)-N-[(1R,2R,3R)-2,3-dimethylcyclohexyl]-2-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]propanamide
CAS Name: (2R)-N-[(1R,2R,3R)-2,3-dimethylcyclohexyl]-2-[4-(4-hydroxyphenyl)-1-piperidin-1-iumyl]propanamide
IUPAC NAME: (2R)-N-[(1R,2R,3R)-2,3-dimethylcyclohexyl]-2-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]propanamide
SYSTEMATIC NAME: (2R)-N-[(1R,2R,3R)-2,3-dimethylcyclohexyl]-2-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]propanamide
MOLECULAR FORMULA: C22H35N2O2+
MOLECULAR WEIGHT: 359.5255
SMILES: C[C@@H]1CCC[C@H]([C@@H]1C)NC(=O)[C@@H](C)[NH+]2CCC(CC2)C3=CC=C(C=C3)O
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