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

Systemtic Name: N-(4-azanylcyclohexyl)-3-[(4-nitrophenyl)carbonylamino]-4-(4-pyridin-3-ylcarbonylpiperazin-1-yl)benzamide Openeye Name: N-(4-aminocyclohexyl)-3-[(4-nitrobenzoyl)amino]-4-[4-(pyridine-3-carbonyl)piperazin-1-yl]benzamide CAS Name: N-(4-aminocyclohexyl)-3-[[(4-nitrophenyl)-oxomethyl]amino]-4-[4-[oxo(3-pyridinyl)methyl]-1-piperazinyl]benzamide IUPAC Name: N-(4-aminocyclohexyl)-3-[(4-nitrobenzoyl)amino]-4-[4-(pyridine-3-carbonyl)piperazin-1-yl]benzamide Traditional Name: N-(4-aminocyclohexyl)-4-(4-nicotinoylpiperazino)-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=CN=CC=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=CN=CC=C4)NC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

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