(2-methoxy-2-oxidanylidene-ethyl) 4,5-dimethoxy-2-nitro-benzoate

Systemtic Name: (2-methoxy-2-oxidanylidene-ethyl) 4,5-dimethoxy-2-nitro-benzoate Openeye Name: (2-methoxy-2-oxo-ethyl) 4,5-dimethoxy-2-nitro-benzoate CAS Name: 4,5-dimethoxy-2-nitrobenzoic acid (2-methoxy-2-oxoethyl) ester IUPAC Name: (2-methoxy-2-oxoethyl) 4,5-dimethoxy-2-nitrobenzoate Traditional Name: 4,5-dimethoxy-2-nitro-benzoic acid (2-keto-2-methoxy-ethyl) ester Formula: C12H13NO8 MolecularWeight: 299.23352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO8/c1-18-9-4-7(12(15)21-6-11(14)20-3)8(13(16)17)5-10(9)19-2/h4-5H,6H2,1-3H3