7-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3,4-dihydro-2H-isoquinolin-1-one

Systemtic Name: 7-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3,4-dihydro-2H-isoquinolin-1-one Openeye Name: 7-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3,4-dihydro-2H-isoquinolin-1-one CAS Name: 7-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-3,4-dihydro-2H-isoquinolin-1-one IUPAC Name: 7-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3,4-dihydro-2H-isoquinolin-1-one Traditional Name: 7-[4-(4-chlorobenzyl)piperazino]-3,4-dihydroisocarbostyril Formula: C20H22ClN3O MolecularWeight: 355.86118

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)C2=C1C=CC(=C2)N3CCN(CC3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CNC(=O)C2=C1C=CC(=C2)N3CCN(CC3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H22ClN3O/c21-17-4-1-15(2-5-17)14-23-9-11-24(12-10-23)18-6-3-16-7-8-22-20(25)19(16)13-18/h1-6,13H,7-12,14H2,(H,22,25)