6,7-dimethoxy-4-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]carbonyl-2-(2-methylpropyl)isoquinolin-1-one

Systemtic Name: 6,7-dimethoxy-4-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]carbonyl-2-(2-methylpropyl)isoquinolin-1-one Openeye Name: 2-isobutyl-6,7-dimethoxy-4-[3-methyl-4-(p-tolyl)piperazine-1-carbonyl]isoquinolin-1-one CAS Name: 6,7-dimethoxy-4-[[3-methyl-4-(4-methylphenyl)-1-piperazinyl]-oxomethyl]-2-(2-methylpropyl)-1-isoquinolinone IUPAC Name: 6,7-dimethoxy-4-[3-methyl-4-(4-methylphenyl)piperazine-1-carbonyl]-2-(2-methylpropyl)isoquinolin-1-one Traditional Name: 2-isobutyl-6,7-dimethoxy-4-[3-methyl-4-(p-tolyl)piperazine-1-carbonyl]isocarbostyril Formula: C28H35N3O4 MolecularWeight: 477.5952

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)C)C(=O)C3=CN(C(=O)C4=CC(=C(C=C43)OC)OC)CC(C)C

Isomeric SMILES

CC1CN(CCN1C2=CC=C(C=C2)C)C(=O)C3=CN(C(=O)C4=CC(=C(C=C43)OC)OC)CC(C)C

InChI

InChI=1S/C28H35N3O4/c1-18(2)15-30-17-24(22-13-25(34-5)26(35-6)14-23(22)27(30)32)28(33)29-11-12-31(20(4)16-29)21-9-7-19(3)8-10-21/h7-10,13-14,17-18,20H,11-12,15-16H2,1-6H3