N-[4-[1-[(4-azanylcyclohexyl)amino]-1-oxidanylidene-propan-2-yl]phenyl]-4-nitro-benzamide

Systemtic Name: N-[4-[1-[(4-azanylcyclohexyl)amino]-1-oxidanylidene-propan-2-yl]phenyl]-4-nitro-benzamide Openeye Name: N-[4-[2-[(4-aminocyclohexyl)amino]-1-methyl-2-oxo-ethyl]phenyl]-4-nitro-benzamide CAS Name: N-[4-[1-[(4-aminocyclohexyl)amino]-1-oxopropan-2-yl]phenyl]-4-nitrobenzamide IUPAC Name: N-[4-[1-[(4-aminocyclohexyl)amino]-1-oxopropan-2-yl]phenyl]-4-nitrobenzamide Traditional Name: N-[4-[2-[(4-aminocyclohexyl)amino]-2-keto-1-methyl-ethyl]phenyl]-4-nitro-benzamide Formula: C22H26N4O4 MolecularWeight: 410.46624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3CCC(CC3)N

Isomeric SMILES

CC(C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3CCC(CC3)N

InChI

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