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

Systemtic Name: 3-(3,4-dimethoxyphenyl)-2-methyl-4-(4-phenylpiperazin-1-yl)carbonyl-3,4-dihydroisoquinolin-1-one Openeye Name: 3-(3,4-dimethoxyphenyl)-2-methyl-4-(4-phenylpiperazine-1-carbonyl)-3,4-dihydroisoquinolin-1-one CAS Name: 3-(3,4-dimethoxyphenyl)-2-methyl-4-[oxo-(4-phenyl-1-piperazinyl)methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 3-(3,4-dimethoxyphenyl)-2-methyl-4-(4-phenylpiperazine-1-carbonyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 3-(3,4-dimethoxyphenyl)-2-methyl-4-(4-phenylpiperazine-1-carbonyl)-3,4-dihydroisocarbostyril Formula: C29H31N3O4 MolecularWeight: 485.57414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H31N3O4/c1-30-27(20-13-14-24(35-2)25(19-20)36-3)26(22-11-7-8-12-23(22)28(30)33)29(34)32-17-15-31(16-18-32)21-9-5-4-6-10-21/h4-14,19,26-27H,15-18H2,1-3H3