N-(3,5-dimethoxyphenyl)-5-nitro-2-[2-(4-pyridin-2-ylpiperazin-1-yl)ethanoylamino]benzamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-5-nitro-2-[2-(4-pyridin-2-ylpiperazin-1-yl)ethanoylamino]benzamide Openeye Name: N-(3,5-dimethoxyphenyl)-5-nitro-2-[[2-[4-(2-pyridyl)piperazin-1-yl]acetyl]amino]benzamide CAS Name: N-(3,5-dimethoxyphenyl)-5-nitro-2-[[1-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]amino]benzamide IUPAC Name: N-(3,5-dimethoxyphenyl)-5-nitro-2-[[2-(4-pyridin-2-ylpiperazin-1-yl)acetyl]amino]benzamide Traditional Name: N-(3,5-dimethoxyphenyl)-5-nitro-2-[[2-[4-(2-pyridyl)piperazino]acetyl]amino]benzamide Formula: C26H28N6O6 MolecularWeight: 520.53712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC(=O)CN3CCN(CC3)C4=CC=CC=N4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC(=O)CN3CCN(CC3)C4=CC=CC=N4)OC

InChI

InChI=1S/C26H28N6O6/c1-37-20-13-18(14-21(16-20)38-2)28-26(34)22-15-19(32(35)36)6-7-23(22)29-25(33)17-30-9-11-31(12-10-30)24-5-3-4-8-27-24/h3-8,13-16H,9-12,17H2,1-2H3,(H,28,34)(H,29,33)