3-[(4,5-dimethoxy-2-nitro-phenyl)methoxy]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[(4,5-dimethoxy-2-nitro-phenyl)methoxy]-3-oxidanylidene-propanoic acid Openeye Name: 3-[(4,5-dimethoxy-2-nitro-phenyl)methoxy]-3-oxo-propanoic acid CAS Name: 3-[(4,5-dimethoxy-2-nitrophenyl)methoxy]-3-oxopropanoic acid IUPAC Name: 3-[(4,5-dimethoxy-2-nitrophenyl)methoxy]-3-oxopropanoic acid Traditional Name: 3-(4,5-dimethoxy-2-nitro-benzyl)oxy-3-keto-propionic acid Formula: C12H13NO8 MolecularWeight: 299.23352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO8/c1-19-9-3-7(6-21-12(16)5-11(14)15)8(13(17)18)4-10(9)20-2/h3-4H,5-6H2,1-2H3,(H,14,15)