methyl 2-(4-nitrophenyl)carbonyl-3-oxidanylidene-butanoate

Systemtic Name: methyl 2-(4-nitrophenyl)carbonyl-3-oxidanylidene-butanoate Openeye Name: methyl 2-(4-nitrobenzoyl)-3-oxo-butanoate CAS Name: 2-[(4-nitrophenyl)-oxomethyl]-3-oxobutanoic acid methyl ester IUPAC Name: methyl 2-(4-nitrobenzoyl)-3-oxobutanoate Traditional Name: 3-keto-2-(4-nitrobenzoyl)butyric acid methyl ester Formula: C12H11NO6 MolecularWeight: 265.21884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11NO6/c1-7(14)10(12(16)19-2)11(15)8-3-5-9(6-4-8)13(17)18/h3-6,10H,1-2H3