4-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1-one

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1-one Openeye Name: 4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1-one CAS Name: 4-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1-one IUPAC Name: 4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2,3-bis(4-methoxyphenyl)-3,4-dihydroisocarbostyril Formula: C34H32ClN3O4 MolecularWeight: 582.08858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)OC)C(=O)N5CCN(CC5)C6=CC(=CC=C6)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2C(C3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)OC)C(=O)N5CCN(CC5)C6=CC(=CC=C6)Cl

InChI

InChI=1S/C34H32ClN3O4/c1-41-27-14-10-23(11-15-27)32-31(34(40)37-20-18-36(19-21-37)26-7-5-6-24(35)22-26)29-8-3-4-9-30(29)33(39)38(32)25-12-16-28(42-2)17-13-25/h3-17,22,31-32H,18-21H2,1-2H3