4-(4,5-dimethoxy-2-nitro-phenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(4,5-dimethoxy-2-nitro-phenyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(4,5-dimethoxy-2-nitro-phenyl)-4-oxo-butanoic acid CAS Name: 4-(4,5-dimethoxy-2-nitrophenyl)-4-oxobutanoic acid IUPAC Name: 4-(4,5-dimethoxy-2-nitrophenyl)-4-oxobutanoic acid Traditional Name: 4-(4,5-dimethoxy-2-nitro-phenyl)-4-keto-butyric acid Formula: C12H13NO7 MolecularWeight: 283.23412

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)CCC(=O)O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)CCC(=O)O)[N+](=O)[O-])OC

InChI

InChI=1S/C12H13NO7/c1-19-10-5-7(9(14)3-4-12(15)16)8(13(17)18)6-11(10)20-2/h5-6H,3-4H2,1-2H3,(H,15,16)