1-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]pyrrolidin-2-one hydrate dihydrochloride

Systemtic Name: 1-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]pyrrolidin-2-one hydrate dihydrochloride Openeye Name: 1-[3-(4-benzhydrylpiperazin-1-yl)propyl]pyrrolidin-2-one hydrate dihydrochloride CAS Name: 1-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-2-pyrrolidinone hydrate dihydrochloride IUPAC Name: 1-[3-(4-benzhydrylpiperazin-1-yl)propyl]pyrrolidin-2-one hydrate dihydrochloride Traditional Name: 1-[3-(4-benzhydrylpiperazino)propyl]-2-pyrrolidone hydrate dihydrochloride Formula: C24H35Cl2N3O2 MolecularWeight: 468.4596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4.O.Cl.Cl

Isomeric SMILES

C1CC(=O)N(C1)CCCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4.O.Cl.Cl

InChI

InChI=1S/C24H31N3O.2ClH.H2O/c28-23-13-7-15-26(23)16-8-14-25-17-19-27(20-18-25)24(21-9-3-1-4-10-21)22-11-5-2-6-12-22;;;/h1-6,9-12,24H,7-8,13-20H2;2*1H;1H2