3,3-diphenyl-5-[(4-phenylpiperazin-1-yl)methyl]oxolan-2-one hydrochloride

Systemtic Name: 3,3-diphenyl-5-[(4-phenylpiperazin-1-yl)methyl]oxolan-2-one hydrochloride Openeye Name: 3,3-diphenyl-5-[(4-phenylpiperazin-1-yl)methyl]tetrahydrofuran-2-one hydrochloride CAS Name: 3,3-diphenyl-5-[(4-phenyl-1-piperazinyl)methyl]-2-oxolanone hydrochloride IUPAC Name: 3,3-diphenyl-5-[(4-phenylpiperazin-1-yl)methyl]oxolan-2-one hydrochloride Traditional Name: 3,3-diphenyl-5-[(4-phenylpiperazino)methyl]tetrahydrofuran-2-one hydrochloride Formula: C27H29ClN2O2 MolecularWeight: 448.98436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2CC(C(=O)O2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.Cl

Isomeric SMILES

C1CN(CCN1CC2CC(C(=O)O2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.Cl

InChI

InChI=1S/C27H28N2O2.ClH/c30-26-27(22-10-4-1-5-11-22,23-12-6-2-7-13-23)20-25(31-26)21-28-16-18-29(19-17-28)24-14-8-3-9-15-24;/h1-15,25H,16-21H2;1H