N-[4-[[(4-azanylcyclohexyl)-[(4-nitrophenyl)methyl]amino]methyl]phenyl]ethanamide

Systemtic Name: N-[4-[[(4-azanylcyclohexyl)-[(4-nitrophenyl)methyl]amino]methyl]phenyl]ethanamide Openeye Name: N-[4-[[(4-aminocyclohexyl)-[(4-nitrophenyl)methyl]amino]methyl]phenyl]acetamide CAS Name: N-[4-[[(4-aminocyclohexyl)-[(4-nitrophenyl)methyl]amino]methyl]phenyl]acetamide IUPAC Name: N-[4-[[(4-aminocyclohexyl)-[(4-nitrophenyl)methyl]amino]methyl]phenyl]acetamide Traditional Name: N-[4-[[(4-aminocyclohexyl)-(4-nitrobenzyl)amino]methyl]phenyl]acetamide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CN(CC2=CC=C(C=C2)[N+](=O)[O-])C3CCC(CC3)N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CN(CC2=CC=C(C=C2)[N+](=O)[O-])C3CCC(CC3)N

InChI

InChI=1S/C22H28N4O3/c1-16(27)24-20-8-2-17(3-9-20)14-25(21-12-6-19(23)7-13-21)15-18-4-10-22(11-5-18)26(28)29/h2-5,8-11,19,21H,6-7,12-15,23H2,1H3,(H,24,27)