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

Systemtic Name: N-[4-[[(4-azanylcyclohexyl)-ethanoyl-amino]methyl]phenyl]-4-nitro-benzamide Openeye Name: N-[4-[[acetyl-(4-aminocyclohexyl)amino]methyl]phenyl]-4-nitro-benzamide CAS Name: N-[4-[[acetyl-(4-aminocyclohexyl)amino]methyl]phenyl]-4-nitrobenzamide IUPAC Name: N-[4-[[acetyl-(4-aminocyclohexyl)amino]methyl]phenyl]-4-nitrobenzamide Traditional Name: N-[4-[[acetyl-(4-aminocyclohexyl)amino]methyl]phenyl]-4-nitro-benzamide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3CCC(CC3)N

Isomeric SMILES

CC(=O)N(CC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3CCC(CC3)N

InChI

InChI=1S/C22H26N4O4/c1-15(27)25(20-12-6-18(23)7-13-20)14-16-2-8-19(9-3-16)24-22(28)17-4-10-21(11-5-17)26(29)30/h2-5,8-11,18,20H,6-7,12-14,23H2,1H3,(H,24,28)