1-cyclohexyl-4-[1-phenyl-2-(4-phenylmethoxyphenyl)ethyl]piperazine hydrate dihydrochloride

Systemtic Name: 1-cyclohexyl-4-[1-phenyl-2-(4-phenylmethoxyphenyl)ethyl]piperazine hydrate dihydrochloride Openeye Name: 1-[2-(4-benzyloxyphenyl)-1-phenyl-ethyl]-4-cyclohexyl-piperazine hydrate dihydrochloride CAS Name: 1-cyclohexyl-4-[1-phenyl-2-(4-phenylmethoxyphenyl)ethyl]piperazine hydrate dihydrochloride IUPAC Name: 1-cyclohexyl-4-[1-phenyl-2-(4-phenylmethoxyphenyl)ethyl]piperazine hydrate dihydrochloride Traditional Name: 1-[2-(4-benzoxyphenyl)-1-phenyl-ethyl]-4-cyclohexyl-piperazine hydrate dihydrochloride Formula: C31H42Cl2N2O2 MolecularWeight: 545.58338

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C(CC3=CC=C(C=C3)OCC4=CC=CC=C4)C5=CC=CC=C5.O.Cl.Cl

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C(CC3=CC=C(C=C3)OCC4=CC=CC=C4)C5=CC=CC=C5.O.Cl.Cl

InChI

InChI=1S/C31H38N2O.2ClH.H2O/c1-4-10-27(11-5-1)25-34-30-18-16-26(17-19-30)24-31(28-12-6-2-7-13-28)33-22-20-32(21-23-33)29-14-8-3-9-15-29;;;/h1-2,4-7,10-13,16-19,29,31H,3,8-9,14-15,20-25H2;2*1H;1H2