5-methoxy-4-[2-(methylamino)-2-oxidanylidene-ethoxy]-2-nitro-benzoic acid

Systemtic Name: 5-methoxy-4-[2-(methylamino)-2-oxidanylidene-ethoxy]-2-nitro-benzoic acid Openeye Name: 5-methoxy-4-[2-(methylamino)-2-oxo-ethoxy]-2-nitro-benzoic acid CAS Name: 5-methoxy-4-[2-(methylamino)-2-oxoethoxy]-2-nitrobenzoic acid IUPAC Name: 5-methoxy-4-[2-(methylamino)-2-oxoethoxy]-2-nitrobenzoic acid Traditional Name: 4-[2-keto-2-(methylamino)ethoxy]-5-methoxy-2-nitro-benzoic acid Formula: C11H12N2O7 MolecularWeight: 284.22218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O7/c1-12-10(14)5-20-9-4-7(13(17)18)6(11(15)16)3-8(9)19-2/h3-4H,5H2,1-2H3,(H,12,14)(H,15,16)