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

Systemtic Name: 2-[1-(phenylmethyl)piperidin-4-yl]-3,4-dihydroisoquinolin-1-one Openeye Name: 2-(1-benzyl-4-piperidyl)-3,4-dihydroisoquinolin-1-one CAS Name: 2-[1-(phenylmethyl)-4-piperidinyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-(1-benzylpiperidin-4-yl)-3,4-dihydroisoquinolin-1-one Traditional Name: 2-(1-benzyl-4-piperidyl)-3,4-dihydroisocarbostyril Formula: C21H24N2O MolecularWeight: 320.42806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O/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