N-(2-methyl-5-nitro-phenyl)-3-oxidanylidene-butanamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-3-oxidanylidene-butanamide Openeye Name: N-(2-methyl-5-nitro-phenyl)-3-oxo-butanamide CAS Name: N-(2-methyl-5-nitrophenyl)-3-oxobutanamide IUPAC Name: N-(2-methyl-5-nitrophenyl)-3-oxobutanamide Traditional Name: 3-keto-N-(2-methyl-5-nitro-phenyl)butyramide Formula: C11H12N2O4 MolecularWeight: 236.22398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O4/c1-7-3-4-9(13(16)17)6-10(7)12-11(15)5-8(2)14/h3-4,6H,5H2,1-2H3,(H,12,15)