3-(1H-indol-3-yl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(3-nitrophenyl)propan-1-one

Systemtic Name: 3-(1H-indol-3-yl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(3-nitrophenyl)propan-1-one Openeye Name: 3-(1H-indol-3-yl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(3-nitrophenyl)propan-1-one CAS Name: 3-(1H-indol-3-yl)-1-[4-(4-methoxyphenyl)-1-piperazinyl]-3-(3-nitrophenyl)-1-propanone IUPAC Name: 3-(1H-indol-3-yl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(3-nitrophenyl)propan-1-one Traditional Name: 3-(1H-indol-3-yl)-1-[4-(4-methoxyphenyl)piperazino]-3-(3-nitrophenyl)propan-1-one Formula: C28H28N4O4 MolecularWeight: 484.54632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CC(C3=CC(=CC=C3)[N+](=O)[O-])C4=CNC5=CC=CC=C54

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CC(C3=CC(=CC=C3)[N+](=O)[O-])C4=CNC5=CC=CC=C54

InChI

InChI=1S/C28H28N4O4/c1-36-23-11-9-21(10-12-23)30-13-15-31(16-14-30)28(33)18-25(20-5-4-6-22(17-20)32(34)35)26-19-29-27-8-3-2-7-24(26)27/h2-12,17,19,25,29H,13-16,18H2,1H3