4-[1-(methylamino)-1-oxidanylidene-propan-2-yl]oxy-3-nitro-benzoic acid

Systemtic Name: 4-[1-(methylamino)-1-oxidanylidene-propan-2-yl]oxy-3-nitro-benzoic acid Openeye Name: 4-[1-methyl-2-(methylamino)-2-oxo-ethoxy]-3-nitro-benzoic acid CAS Name: 4-[1-(methylamino)-1-oxopropan-2-yl]oxy-3-nitrobenzoic acid IUPAC Name: 4-[1-(methylamino)-1-oxopropan-2-yl]oxy-3-nitrobenzoic acid Traditional Name: 4-[2-keto-1-methyl-2-(methylamino)ethoxy]-3-nitro-benzoic acid Formula: C11H12N2O6 MolecularWeight: 268.22278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC)OC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC)OC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H12N2O6/c1-6(10(14)12-2)19-9-4-3-7(11(15)16)5-8(9)13(17)18/h3-6H,1-2H3,(H,12,14)(H,15,16)