3-(1H-indol-3-yl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-2-methyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 3-(1H-indol-3-yl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-2-methyl-3,4-dihydroisoquinolin-1-one Openeye Name: 3-(1H-indol-3-yl)-4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-2-methyl-3,4-dihydroisoquinolin-1-one CAS Name: 3-(1H-indol-3-yl)-4-[[4-(4-methoxyphenyl)-1-piperazinyl]-oxomethyl]-2-methyl-3,4-dihydroisoquinolin-1-one IUPAC Name: 3-(1H-indol-3-yl)-4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-2-methyl-3,4-dihydroisoquinolin-1-one Traditional Name: 3-(1H-indol-3-yl)-4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-2-methyl-3,4-dihydroisocarbostyril Formula: C30H30N4O3 MolecularWeight: 494.5842

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=C(C=C4)OC)C5=CNC6=CC=CC=C65

Isomeric SMILES

CN1C(C(C2=CC=CC=C2C1=O)C(=O)N3CCN(CC3)C4=CC=C(C=C4)OC)C5=CNC6=CC=CC=C65

InChI

InChI=1S/C30H30N4O3/c1-32-28(25-19-31-26-10-6-5-7-22(25)26)27(23-8-3-4-9-24(23)29(32)35)30(36)34-17-15-33(16-18-34)20-11-13-21(37-2)14-12-20/h3-14,19,27-28,31H,15-18H2,1-2H3