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

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-3-(3,4-dimethoxyphenyl)-2-methyl-3,4-dihydroisoquinolin-1-one Openeye Name: 4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-(3,4-dimethoxyphenyl)-2-methyl-3,4-dihydroisoquinolin-1-one CAS Name: 4-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-3-(3,4-dimethoxyphenyl)-2-methyl-3,4-dihydroisoquinolin-1-one IUPAC Name: 4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-(3,4-dimethoxyphenyl)-2-methyl-3,4-dihydroisoquinolin-1-one Traditional Name: 4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-(3,4-dimethoxyphenyl)-2-methyl-3,4-dihydroisocarbostyril Formula: C29H30ClN3O4 MolecularWeight: 520.0192

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC=CC=C2C1=O)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)C5=CC(=C(C=C5)OC)OC

Isomeric SMILES

CN1C(C(C2=CC=CC=C2C1=O)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)C5=CC(=C(C=C5)OC)OC

InChI

InChI=1S/C29H30ClN3O4/c1-31-27(19-11-12-24(36-2)25(17-19)37-3)26(22-9-4-5-10-23(22)28(31)34)29(35)33-15-13-32(14-16-33)21-8-6-7-20(30)18-21/h4-12,17-18,26-27H,13-16H2,1-3H3