(3E)-N-(2-methyl-5-nitro-phenyl)-3-(3-phenylpropanoylhydrazinylidene)butanamide

Systemtic Name: (3E)-N-(2-methyl-5-nitro-phenyl)-3-(3-phenylpropanoylhydrazinylidene)butanamide Openeye Name: (3E)-N-(2-methyl-5-nitro-phenyl)-3-(3-phenylpropanoylhydrazono)butanamide CAS Name: (3E)-N-(2-methyl-5-nitrophenyl)-3-[(1-oxo-3-phenylpropyl)hydrazinylidene]butanamide IUPAC Name: (3E)-N-(2-methyl-5-nitrophenyl)-3-(3-phenylpropanoylhydrazinylidene)butanamide Traditional Name: (3E)-3-(hydrocinnamoylhydrazono)-N-(2-methyl-5-nitro-phenyl)butyramide Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CC(=NNC(=O)CCC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C/C(=N/NC(=O)CCC2=CC=CC=C2)/C

InChI

InChI=1S/C20H22N4O4/c1-14-8-10-17(24(27)28)13-18(14)21-20(26)12-15(2)22-23-19(25)11-9-16-6-4-3-5-7-16/h3-8,10,13H,9,11-12H2,1-2H3,(H,21,26)(H,23,25)/b22-15+