3-azanyl-5-cyano-N,3,4-trimethyl-N-[4-nitro-2-(phenylcarbonyl)phenyl]pentanamide

Systemtic Name: 3-azanyl-5-cyano-N,3,4-trimethyl-N-[4-nitro-2-(phenylcarbonyl)phenyl]pentanamide Openeye Name: 3-amino-N-(2-benzoyl-4-nitro-phenyl)-5-cyano-N,3,4-trimethyl-pentanamide CAS Name: 3-amino-N-(2-benzoyl-4-nitrophenyl)-5-cyano-N,3,4-trimethylpentanamide IUPAC Name: 3-amino-N-(2-benzoyl-4-nitrophenyl)-5-cyano-N,3,4-trimethylpentanamide Traditional Name: 3-amino-N-(2-benzoyl-4-nitro-phenyl)-5-cyano-N,3,4-trimethyl-valeramide Formula: C22H24N4O4 MolecularWeight: 408.45036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC#N)C(C)(CC(=O)N(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)C2=CC=CC=C2)N

Isomeric SMILES

CC(CC#N)C(C)(CC(=O)N(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)C2=CC=CC=C2)N

InChI

InChI=1S/C22H24N4O4/c1-15(11-12-23)22(2,24)14-20(27)25(3)19-10-9-17(26(29)30)13-18(19)21(28)16-7-5-4-6-8-16/h4-10,13,15H,11,14,24H2,1-3H3