methyl 3-(2-methoxy-2-oxidanylidene-ethyl)-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxylate

Systemtic Name: methyl 3-(2-methoxy-2-oxidanylidene-ethyl)-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxylate Openeye Name: methyl 3-(2-methoxy-2-oxo-ethyl)-4-oxido-1-oxo-quinoxalin-1-ium-2-carboxylate CAS Name: 3-(2-methoxy-2-oxoethyl)-4-oxido-1-oxo-2-quinoxalin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 3-(2-methoxy-2-oxoethyl)-4-oxido-1-oxoquinoxalin-1-ium-2-carboxylate Traditional Name: 1-keto-3-(2-keto-2-methoxy-ethyl)-4-oxido-quinoxalin-1-ium-2-carboxylic acid methyl ester Formula: C13H12N2O6 MolecularWeight: 292.24418

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C([N+](=O)C2=CC=CC=C2N1[O-])C(=O)OC

Isomeric SMILES

COC(=O)CC1=C([N+](=O)C2=CC=CC=C2N1[O-])C(=O)OC

InChI

InChI=1S/C13H12N2O6/c1-20-11(16)7-10-12(13(17)21-2)15(19)9-6-4-3-5-8(9)14(10)18/h3-6H,7H2,1-2H3