[2-[(4,5-dimethyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] propanoate

Systemtic Name: [2-[(4,5-dimethyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] propanoate Openeye Name: [2-(4,5-dimethyl-2-nitro-anilino)-2-oxo-ethyl] propanoate CAS Name: propanoic acid [2-(4,5-dimethyl-2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4,5-dimethyl-2-nitroanilino)-2-oxoethyl] propanoate Traditional Name: propionic acid [2-(4,5-dimethyl-2-nitro-anilino)-2-keto-ethyl] ester Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O5/c1-4-13(17)20-7-12(16)14-10-5-8(2)9(3)6-11(10)15(18)19/h5-6H,4,7H2,1-3H3,(H,14,16)