N-[3-(1H-indol-3-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-2,6-dimethoxy-pyridine-3-carboxamide

Systemtic Name: N-[3-(1H-indol-3-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-2,6-dimethoxy-pyridine-3-carboxamide Openeye Name: N-[1-(1H-indol-3-ylmethyl)-2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxo-ethyl]-2,6-dimethoxy-pyridine-3-carboxamide CAS Name: N-[3-(1H-indol-3-yl)-1-[4-(4-nitrophenyl)-1-piperazinyl]-1-oxopropan-2-yl]-2,6-dimethoxy-3-pyridinecarboxamide IUPAC Name: N-[3-(1H-indol-3-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxopropan-2-yl]-2,6-dimethoxypyridine-3-carboxamide Traditional Name: N-[1-(1H-indol-3-ylmethyl)-2-keto-2-[4-(4-nitrophenyl)piperazino]ethyl]-2,6-dimethoxy-nicotinamide Formula: C29H30N6O6 MolecularWeight: 558.5851

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=C(C=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-])OC

Isomeric SMILES

COC1=NC(=C(C=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-])OC

InChI

InChI=1S/C29H30N6O6/c1-40-26-12-11-23(28(32-26)41-2)27(36)31-25(17-19-18-30-24-6-4-3-5-22(19)24)29(37)34-15-13-33(14-16-34)20-7-9-21(10-8-20)35(38)39/h3-12,18,25,30H,13-17H2,1-2H3,(H,31,36)