N-[4-[[(2-azanylcyclohexyl)-(phenylcarbonyl)amino]methyl]phenyl]-4-nitro-benzamide

Systemtic Name: N-[4-[[(2-azanylcyclohexyl)-(phenylcarbonyl)amino]methyl]phenyl]-4-nitro-benzamide Openeye Name: N-[4-[[(2-aminocyclohexyl)-benzoyl-amino]methyl]phenyl]-4-nitro-benzamide CAS Name: N-[4-[[(2-aminocyclohexyl)-benzoylamino]methyl]phenyl]-4-nitrobenzamide IUPAC Name: N-[4-[[(2-aminocyclohexyl)-benzoylamino]methyl]phenyl]-4-nitrobenzamide Traditional Name: N-[4-[[(2-aminocyclohexyl)-benzoyl-amino]methyl]phenyl]-4-nitro-benzamide Formula: C27H28N4O4 MolecularWeight: 472.53562

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)N(CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C(C1)N)N(CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H28N4O4/c28-24-8-4-5-9-25(24)30(27(33)21-6-2-1-3-7-21)18-19-10-14-22(15-11-19)29-26(32)20-12-16-23(17-13-20)31(34)35/h1-3,6-7,10-17,24-25H,4-5,8-9,18,28H2,(H,29,32)