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

Systemtic Name: N-[2-[[(2-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]phenyl]-4-nitro-benzamide Openeye Name: N-[2-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-4-nitro-benzamide CAS Name: N-[2-[[(2-aminocyclohexyl)-[cyclopropyl(oxo)methyl]amino]methyl]phenyl]-4-nitrobenzamide IUPAC Name: N-[2-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-4-nitrobenzamide Traditional Name: N-[2-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-4-nitro-benzamide Formula: C24H28N4O4 MolecularWeight: 436.50352

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)N(CC2=CC=CC=C2NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4CC4

Isomeric SMILES

C1CCC(C(C1)N)N(CC2=CC=CC=C2NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4CC4

InChI

InChI=1S/C24H28N4O4/c25-20-6-2-4-8-22(20)27(24(30)17-9-10-17)15-18-5-1-3-7-21(18)26-23(29)16-11-13-19(14-12-16)28(31)32/h1,3,5,7,11-14,17,20,22H,2,4,6,8-10,15,25H2,(H,26,29)