ethyl 4-[(2-methyl-3-nitro-phenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[(2-methyl-3-nitro-phenyl)amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-(2-methyl-3-nitro-anilino)-4-oxo-butanoate CAS Name: 4-(2-methyl-3-nitroanilino)-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(2-methyl-3-nitroanilino)-4-oxobutanoate Traditional Name: 4-keto-4-(2-methyl-3-nitro-anilino)butyric acid ethyl ester Formula: C13H16N2O5 MolecularWeight: 280.27654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC1=C(C(=CC=C1)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)CCC(=O)NC1=C(C(=CC=C1)[N+](=O)[O-])C

InChI

InChI=1S/C13H16N2O5/c1-3-20-13(17)8-7-12(16)14-10-5-4-6-11(9(10)2)15(18)19/h4-6H,3,7-8H2,1-2H3,(H,14,16)