2-[1-(phenylmethyl)piperidin-4-yl]-3,4-dihydroisoquinolin-1-one hydrochloride

Systemtic Name: 2-[1-(phenylmethyl)piperidin-4-yl]-3,4-dihydroisoquinolin-1-one hydrochloride Openeye Name: 2-(1-benzyl-4-piperidyl)-3,4-dihydroisoquinolin-1-one hydrochloride CAS Name: 2-[1-(phenylmethyl)-4-piperidinyl]-3,4-dihydroisoquinolin-1-one hydrochloride IUPAC Name: 2-(1-benzylpiperidin-4-yl)-3,4-dihydroisoquinolin-1-one hydrochloride Traditional Name: 2-(1-benzyl-4-piperidyl)-3,4-dihydroisocarbostyril hydrochloride Formula: C21H25ClN2O MolecularWeight: 356.889

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CCC3=CC=CC=C3C2=O)CC4=CC=CC=C4.Cl

Isomeric SMILES

C1CN(CCC1N2CCC3=CC=CC=C3C2=O)CC4=CC=CC=C4.Cl

InChI

InChI=1S/C21H24N2O.ClH/c24-21-20-9-5-4-8-18(20)10-15-23(21)19-11-13-22(14-12-19)16-17-6-2-1-3-7-17;/h1-9,19H,10-16H2;1H