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

Systemtic Name: 3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-4-[4-(phenylmethyl)piperazin-1-yl]carbonyl-3,4-dihydroisoquinolin-1-one Openeye Name: 4-(4-benzylpiperazine-1-carbonyl)-3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-1-one CAS Name: 3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-4-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 4-(4-benzylpiperazine-1-carbonyl)-3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-1-one Traditional Name: 4-(4-benzylpiperazine-1-carbonyl)-3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-3,4-dihydroisocarbostyril Formula: C30H32FN3O4 MolecularWeight: 517.591183

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CC=CC=C5F

Isomeric SMILES

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CC=CC=C5F

InChI

InChI=1S/C30H32FN3O4/c1-32-28(21-11-7-8-12-24(21)31)27(22-17-25(37-2)26(38-3)18-23(22)29(32)35)30(36)34-15-13-33(14-16-34)19-20-9-5-4-6-10-20/h4-12,17-18,27-28H,13-16,19H2,1-3H3