1-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-5-phenyl-pyrrolidin-2-one hydrate dihydrochloride

Systemtic Name: 1-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-5-phenyl-pyrrolidin-2-one hydrate dihydrochloride Openeye Name: 1-[3-(4-benzhydrylpiperazin-1-yl)propyl]-5-phenyl-pyrrolidin-2-one hydrate dihydrochloride CAS Name: 1-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-5-phenyl-2-pyrrolidinone hydrate dihydrochloride IUPAC Name: 1-[3-(4-benzhydrylpiperazin-1-yl)propyl]-5-phenylpyrrolidin-2-one hydrate dihydrochloride Traditional Name: 1-[3-(4-benzhydrylpiperazino)propyl]-5-phenyl-2-pyrrolidone hydrate dihydrochloride Formula: C30H39Cl2N3O2 MolecularWeight: 544.55556

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1C2=CC=CC=C2)CCCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5.O.Cl.Cl

Isomeric SMILES

C1CC(=O)N(C1C2=CC=CC=C2)CCCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5.O.Cl.Cl

InChI

InChI=1S/C30H35N3O.2ClH.H2O/c34-29-18-17-28(25-11-4-1-5-12-25)33(29)20-10-19-31-21-23-32(24-22-31)30(26-13-6-2-7-14-26)27-15-8-3-9-16-27;;;/h1-9,11-16,28,30H,10,17-24H2;2*1H;1H2