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

Systemtic Name: 3-azanyl-5-cyano-N,4-dimethyl-N-[4-nitro-2-(phenylcarbonyl)phenyl]pentanamide Openeye Name: 3-amino-N-(2-benzoyl-4-nitro-phenyl)-5-cyano-N,4-dimethyl-pentanamide CAS Name: 3-amino-N-(2-benzoyl-4-nitrophenyl)-5-cyano-N,4-dimethylpentanamide IUPAC Name: 3-amino-N-(2-benzoyl-4-nitrophenyl)-5-cyano-N,4-dimethylpentanamide Traditional Name: 3-amino-N-(2-benzoyl-4-nitro-phenyl)-5-cyano-N,4-dimethyl-valeramide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C21H22N4O4/c1-14(10-11-22)18(23)13-20(26)24(2)19-9-8-16(25(28)29)12-17(19)21(27)15-6-4-3-5-7-15/h3-9,12,14,18H,10,13,23H2,1-2H3