3-(1-methylindol-3-yl)-3-(4-methylphenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(1-methylindol-3-yl)-3-(4-methylphenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(1-methylindol-3-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]-3-(p-tolyl)propan-1-one CAS Name: 3-(1-methyl-3-indolyl)-3-(4-methylphenyl)-1-[4-(4-nitrophenyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(1-methylindol-3-yl)-3-(4-methylphenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(1-methylindol-3-yl)-1-[4-(4-nitrophenyl)piperazino]-3-(p-tolyl)propan-1-one Formula: C29H30N4O3 MolecularWeight: 482.5735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CN(C5=CC=CC=C54)C

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CN(C5=CC=CC=C54)C

InChI

InChI=1S/C29H30N4O3/c1-21-7-9-22(10-8-21)26(27-20-30(2)28-6-4-3-5-25(27)28)19-29(34)32-17-15-31(16-18-32)23-11-13-24(14-12-23)33(35)36/h3-14,20,26H,15-19H2,1-2H3