3-(3,4-dimethoxyphenyl)-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-3,4-dihydroisoquinolin-1-one Openeye Name: 3-(3,4-dimethoxyphenyl)-2-methyl-4-[4-(2-pyridyl)piperazine-1-carbonyl]-3,4-dihydroisoquinolin-1-one CAS Name: 3-(3,4-dimethoxyphenyl)-2-methyl-4-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 3-(3,4-dimethoxyphenyl)-2-methyl-4-(4-pyridin-2-ylpiperazine-1-carbonyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 3-(3,4-dimethoxyphenyl)-2-methyl-4-[4-(2-pyridyl)piperazine-1-carbonyl]-3,4-dihydroisocarbostyril Formula: C28H30N4O4 MolecularWeight: 486.5622

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC=CC=C2C1=O)C(=O)N3CCN(CC3)C4=CC=CC=N4)C5=CC(=C(C=C5)OC)OC

Isomeric SMILES

CN1C(C(C2=CC=CC=C2C1=O)C(=O)N3CCN(CC3)C4=CC=CC=N4)C5=CC(=C(C=C5)OC)OC

InChI

InChI=1S/C28H30N4O4/c1-30-26(19-11-12-22(35-2)23(18-19)36-3)25(20-8-4-5-9-21(20)27(30)33)28(34)32-16-14-31(15-17-32)24-10-6-7-13-29-24/h4-13,18,25-26H,14-17H2,1-3H3