3-(1H-indol-3-yl)-3-(3-methylphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(1H-indol-3-yl)-3-(3-methylphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(1H-indol-3-yl)-3-(m-tolyl)-1-[4-(o-tolyl)piperazin-1-yl]propan-1-one CAS Name: 3-(1H-indol-3-yl)-3-(3-methylphenyl)-1-[4-(2-methylphenyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(1H-indol-3-yl)-3-(3-methylphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(1H-indol-3-yl)-3-(m-tolyl)-1-[4-(o-tolyl)piperazino]propan-1-one Formula: C29H31N3O MolecularWeight: 437.57594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(CC(=O)N2CCN(CC2)C3=CC=CC=C3C)C4=CNC5=CC=CC=C54

Isomeric SMILES

CC1=CC(=CC=C1)C(CC(=O)N2CCN(CC2)C3=CC=CC=C3C)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C29H31N3O/c1-21-8-7-10-23(18-21)25(26-20-30-27-12-5-4-11-24(26)27)19-29(33)32-16-14-31(15-17-32)28-13-6-3-9-22(28)2/h3-13,18,20,25,30H,14-17,19H2,1-2H3