N-(4-azanylcyclohexyl)-3-[(4-nitrophenyl)carbonylamino]-4-[4-(2-phenylethanoyl)piperazin-1-yl]benzamide

Systemtic Name: N-(4-azanylcyclohexyl)-3-[(4-nitrophenyl)carbonylamino]-4-[4-(2-phenylethanoyl)piperazin-1-yl]benzamide Openeye Name: N-(4-aminocyclohexyl)-3-[(4-nitrobenzoyl)amino]-4-[4-(2-phenylacetyl)piperazin-1-yl]benzamide CAS Name: N-(4-aminocyclohexyl)-3-[[(4-nitrophenyl)-oxomethyl]amino]-4-[4-(1-oxo-2-phenylethyl)-1-piperazinyl]benzamide IUPAC Name: N-(4-aminocyclohexyl)-3-[(4-nitrobenzoyl)amino]-4-[4-(2-phenylacetyl)piperazin-1-yl]benzamide Traditional Name: N-(4-aminocyclohexyl)-3-[(4-nitrobenzoyl)amino]-4-[4-(2-phenylacetyl)piperazino]benzamide Formula: C32H36N6O5 MolecularWeight: 584.66544

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)CC4=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)CC4=CC=CC=C4)NC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C32H36N6O5/c33-25-9-11-26(12-10-25)34-32(41)24-8-15-29(28(21-24)35-31(40)23-6-13-27(14-7-23)38(42)43)36-16-18-37(19-17-36)30(39)20-22-4-2-1-3-5-22/h1-8,13-15,21,25-26H,9-12,16-20,33H2,(H,34,41)(H,35,40)