[2-[(4,5-dimethyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 6-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: [2-[(4,5-dimethyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 6-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: [2-(4,5-dimethyl-2-nitro-anilino)-2-oxo-ethyl] 6-oxo-1H-pyridine-3-carboxylate CAS Name: 6-oxo-1H-pyridine-3-carboxylic acid [2-(4,5-dimethyl-2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4,5-dimethyl-2-nitroanilino)-2-oxoethyl] 6-oxo-1H-pyridine-3-carboxylate Traditional Name: 6-keto-1H-pyridine-3-carboxylic acid [2-(4,5-dimethyl-2-nitro-anilino)-2-keto-ethyl] ester Formula: C16H15N3O6 MolecularWeight: 345.3068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)COC(=O)C2=CNC(=O)C=C2

Isomeric SMILES

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)COC(=O)C2=CNC(=O)C=C2

InChI

InChI=1S/C16H15N3O6/c1-9-5-12(13(19(23)24)6-10(9)2)18-15(21)8-25-16(22)11-3-4-14(20)17-7-11/h3-7H,8H2,1-2H3,(H,17,20)(H,18,21)