1-[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]pyrrolidin-2-one hydrate hydrochloride

Systemtic Name: 1-[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]pyrrolidin-2-one hydrate hydrochloride Openeye Name: 1-[2-(4-benzhydrylpiperazin-1-yl)-2-oxo-ethyl]pyrrolidin-2-one hydrate hydrochloride CAS Name: 1-[2-[4-(diphenylmethyl)-1-piperazinyl]-2-oxoethyl]-2-pyrrolidinone hydrate hydrochloride IUPAC Name: 1-[2-(4-benzhydrylpiperazin-1-yl)-2-oxoethyl]pyrrolidin-2-one hydrate hydrochloride Traditional Name: 1-[2-(4-benzhydrylpiperazino)-2-keto-ethyl]-2-pyrrolidone hydrate hydrochloride Formula: C23H30ClN3O3 MolecularWeight: 431.9556

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4.O.Cl

Isomeric SMILES

C1CC(=O)N(C1)CC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4.O.Cl

InChI

InChI=1S/C23H27N3O2.ClH.H2O/c27-21-12-7-13-26(21)18-22(28)24-14-16-25(17-15-24)23(19-8-3-1-4-9-19)20-10-5-2-6-11-20;;/h1-6,8-11,23H,7,12-18H2;1H;1H2