2-[[1-(2-oxidanylidene-3-phenyl-propyl)piperidin-4-yl]methyl]-3H-isoindol-1-one hydrochloride

Systemtic Name: 2-[[1-(2-oxidanylidene-3-phenyl-propyl)piperidin-4-yl]methyl]-3H-isoindol-1-one hydrochloride Openeye Name: 2-[[1-(2-oxo-3-phenyl-propyl)-4-piperidyl]methyl]isoindolin-1-one hydrochloride CAS Name: 2-[[1-(2-oxo-3-phenylpropyl)-4-piperidinyl]methyl]-3H-isoindol-1-one hydrochloride IUPAC Name: 2-[[1-(2-oxo-3-phenylpropyl)piperidin-4-yl]methyl]-3H-isoindol-1-one hydrochloride Traditional Name: 2-[[1-(2-keto-3-phenyl-propyl)-4-piperidyl]methyl]isoindolin-1-one hydrochloride Formula: C23H27ClN2O2 MolecularWeight: 398.92568

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CC3=CC=CC=C3C2=O)CC(=O)CC4=CC=CC=C4.Cl

Isomeric SMILES

C1CN(CCC1CN2CC3=CC=CC=C3C2=O)CC(=O)CC4=CC=CC=C4.Cl

InChI

InChI=1S/C23H26N2O2.ClH/c26-21(14-18-6-2-1-3-7-18)17-24-12-10-19(11-13-24)15-25-16-20-8-4-5-9-22(20)23(25)27;/h1-9,19H,10-17H2;1H