N-(4-azanylcyclohexyl)-3-[(4-nitrophenyl)carbonylamino]-4-(4-pyridin-4-ylcarbonylpiperazin-1-yl)benzamide

Systemtic Name: N-(4-azanylcyclohexyl)-3-[(4-nitrophenyl)carbonylamino]-4-(4-pyridin-4-ylcarbonylpiperazin-1-yl)benzamide Openeye Name: N-(4-aminocyclohexyl)-3-[(4-nitrobenzoyl)amino]-4-[4-(pyridine-4-carbonyl)piperazin-1-yl]benzamide CAS Name: N-(4-aminocyclohexyl)-3-[[(4-nitrophenyl)-oxomethyl]amino]-4-[4-[oxo(pyridin-4-yl)methyl]-1-piperazinyl]benzamide IUPAC Name: N-(4-aminocyclohexyl)-3-[(4-nitrobenzoyl)amino]-4-[4-(pyridine-4-carbonyl)piperazin-1-yl]benzamide Traditional Name: N-(4-aminocyclohexyl)-4-(4-isonicotinoylpiperazino)-3-[(4-nitrobenzoyl)amino]benzamide Formula: C30H33N7O5 MolecularWeight: 571.62692

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=NC=C4)NC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CC(CCC1N)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=NC=C4)NC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C30H33N7O5/c31-23-4-6-24(7-5-23)33-29(39)22-3-10-27(26(19-22)34-28(38)20-1-8-25(9-2-20)37(41)42)35-15-17-36(18-16-35)30(40)21-11-13-32-14-12-21/h1-3,8-14,19,23-24H,4-7,15-18,31H2,(H,33,39)(H,34,38)