1-cyclobutyl-3-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]-1-oxidanyl-1-phenyl-propan-2-one dihydrochloride

Systemtic Name: 1-cyclobutyl-3-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]-1-oxidanyl-1-phenyl-propan-2-one dihydrochloride Openeye Name: 1-cyclobutyl-1-hydroxy-3-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]-1-phenyl-propan-2-one dihydrochloride CAS Name: 1-cyclobutyl-1-hydroxy-3-[4-[(4-nitrophenyl)methyl]-1-piperazinyl]-1-phenyl-2-propanone dihydrochloride IUPAC Name: 1-cyclobutyl-1-hydroxy-3-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]-1-phenylpropan-2-one dihydrochloride Traditional Name: 1-cyclobutyl-1-hydroxy-3-[4-(4-nitrobenzyl)piperazino]-1-phenyl-acetone dihydrochloride Formula: C24H31Cl2N3O4 MolecularWeight: 496.42664

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(C2=CC=CC=C2)(C(=O)CN3CCN(CC3)CC4=CC=C(C=C4)[N+](=O)[O-])O.Cl.Cl

Isomeric SMILES

C1CC(C1)C(C2=CC=CC=C2)(C(=O)CN3CCN(CC3)CC4=CC=C(C=C4)[N+](=O)[O-])O.Cl.Cl

InChI

InChI=1S/C24H29N3O4.2ClH/c28-23(24(29,21-7-4-8-21)20-5-2-1-3-6-20)18-26-15-13-25(14-16-26)17-19-9-11-22(12-10-19)27(30)31;;/h1-3,5-6,9-12,21,29H,4,7-8,13-18H2;2*1H