methyl 3-ethanoyl-2-methyl-1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-6-carboxylate

Systemtic Name: methyl 3-ethanoyl-2-methyl-1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-6-carboxylate Openeye Name: methyl 3-acetyl-2-methyl-1-oxido-4-oxo-quinoxalin-4-ium-6-carboxylate CAS Name: 3-acetyl-2-methyl-1-oxido-4-oxo-6-quinoxalin-4-iumcarboxylic acid methyl ester IUPAC Name: methyl 3-acetyl-2-methyl-1-oxido-4-oxoquinoxalin-4-ium-6-carboxylate Traditional Name: 3-acetyl-4-keto-2-methyl-1-oxido-quinoxalin-4-ium-6-carboxylic acid methyl ester Formula: C13H12N2O5 MolecularWeight: 276.24478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=O)C2=C(N1[O-])C=CC(=C2)C(=O)OC)C(=O)C

Isomeric SMILES

CC1=C([N+](=O)C2=C(N1[O-])C=CC(=C2)C(=O)OC)C(=O)C

InChI

InChI=1S/C13H12N2O5/c1-7-12(8(2)16)15(19)11-6-9(13(17)20-3)4-5-10(11)14(7)18/h4-6H,1-3H3