2-[2-[4-(4-chlorophenyl)piperazin-1-yl]ethyl]-5-methoxy-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-[2-[4-(4-chlorophenyl)piperazin-1-yl]ethyl]-5-methoxy-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[2-[4-(4-chlorophenyl)piperazin-1-yl]ethyl]-5-methoxy-3,4-dihydroisoquinolin-1-one CAS Name: 2-[2-[4-(4-chlorophenyl)-1-piperazinyl]ethyl]-5-methoxy-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[2-[4-(4-chlorophenyl)piperazin-1-yl]ethyl]-5-methoxy-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[2-[4-(4-chlorophenyl)piperazino]ethyl]-5-methoxy-3,4-dihydroisocarbostyril Formula: C22H26ClN3O2 MolecularWeight: 399.91374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1CCN(C2=O)CCN3CCN(CC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=CC2=C1CCN(C2=O)CCN3CCN(CC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H26ClN3O2/c1-28-21-4-2-3-20-19(21)9-10-26(22(20)27)16-13-24-11-14-25(15-12-24)18-7-5-17(23)6-8-18/h2-8H,9-16H2,1H3