4-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-6,7-dimethoxy-2-methyl-3-pyridin-3-yl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-6,7-dimethoxy-2-methyl-3-pyridin-3-yl-3,4-dihydroisoquinolin-1-one Openeye Name: 4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-6,7-dimethoxy-2-methyl-3-(3-pyridyl)-3,4-dihydroisoquinolin-1-one CAS Name: 4-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-6,7-dimethoxy-2-methyl-3-(3-pyridinyl)-3,4-dihydroisoquinolin-1-one IUPAC Name: 4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-6,7-dimethoxy-2-methyl-3-pyridin-3-yl-3,4-dihydroisoquinolin-1-one Traditional Name: 4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-6,7-dimethoxy-2-methyl-3-(3-pyridyl)-3,4-dihydroisocarbostyril Formula: C28H29ClN4O4 MolecularWeight: 521.00726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29ClN4O4/c1-31-26(18-6-5-9-30-17-18)25(21-15-23(36-2)24(37-3)16-22(21)27(31)34)28(35)33-12-10-32(11-13-33)20-8-4-7-19(29)14-20/h4-9,14-17,25-26H,10-13H2,1-3H3