N-(4-azanylcyclohexyl)-3-[(4-nitrophenyl)carbonylamino]-4-[4-(phenylcarbonyl)piperazin-1-yl]benzamide

Systemtic Name: N-(4-azanylcyclohexyl)-3-[(4-nitrophenyl)carbonylamino]-4-[4-(phenylcarbonyl)piperazin-1-yl]benzamide Openeye Name: N-(4-aminocyclohexyl)-4-(4-benzoylpiperazin-1-yl)-3-[(4-nitrobenzoyl)amino]benzamide CAS Name: N-(4-aminocyclohexyl)-4-(4-benzoyl-1-piperazinyl)-3-[[(4-nitrophenyl)-oxomethyl]amino]benzamide IUPAC Name: N-(4-aminocyclohexyl)-4-(4-benzoylpiperazin-1-yl)-3-[(4-nitrobenzoyl)amino]benzamide Traditional Name: N-(4-aminocyclohexyl)-4-(4-benzoylpiperazino)-3-[(4-nitrobenzoyl)amino]benzamide Formula: C31H34N6O5 MolecularWeight: 570.63886

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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=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=CC=CC=C4)NC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C31H34N6O5/c32-24-9-11-25(12-10-24)33-30(39)23-8-15-28(27(20-23)34-29(38)21-6-13-26(14-7-21)37(41)42)35-16-18-36(19-17-35)31(40)22-4-2-1-3-5-22/h1-8,13-15,20,24-25H,9-12,16-19,32H2,(H,33,39)(H,34,38)