3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-N-[2-(4-methylpiperazin-1-yl)phenyl]-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-N-[2-(4-methylpiperazin-1-yl)phenyl]-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-N-[2-(4-methylpiperazin-1-yl)phenyl]-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-N-[2-(4-methyl-1-piperazinyl)phenyl]-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 3-(2-fluorophenyl)-6,7-dimethoxy-2-methyl-N-[2-(4-methylpiperazin-1-yl)phenyl]-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 3-(2-fluorophenyl)-1-keto-6,7-dimethoxy-2-methyl-N-[2-(4-methylpiperazino)phenyl]-3,4-dihydroisoquinoline-4-carboxamide Formula: C30H33FN4O4 MolecularWeight: 532.605823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC=C2NC(=O)C3C(N(C(=O)C4=CC(=C(C=C34)OC)OC)C)C5=CC=CC=C5F

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC=C2NC(=O)C3C(N(C(=O)C4=CC(=C(C=C34)OC)OC)C)C5=CC=CC=C5F

InChI

InChI=1S/C30H33FN4O4/c1-33-13-15-35(16-14-33)24-12-8-7-11-23(24)32-29(36)27-20-17-25(38-3)26(39-4)18-21(20)30(37)34(2)28(27)19-9-5-6-10-22(19)31/h5-12,17-18,27-28H,13-16H2,1-4H3,(H,32,36)