methyl 3-ethyl-6,7-dimethyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxylate

Systemtic Name: methyl 3-ethyl-6,7-dimethyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxylate Openeye Name: methyl 3-ethyl-6,7-dimethyl-4-oxido-1-oxo-quinoxalin-1-ium-2-carboxylate CAS Name: 3-ethyl-6,7-dimethyl-4-oxido-1-oxo-2-quinoxalin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 3-ethyl-6,7-dimethyl-4-oxido-1-oxoquinoxalin-1-ium-2-carboxylate Traditional Name: 3-ethyl-1-keto-6,7-dimethyl-4-oxido-quinoxalin-1-ium-2-carboxylic acid methyl ester Formula: C14H16N2O4 MolecularWeight: 276.28784

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C([N+](=O)C2=C(N1[O-])C=C(C(=C2)C)C)C(=O)OC

Isomeric SMILES

CCC1=C([N+](=O)C2=C(N1[O-])C=C(C(=C2)C)C)C(=O)OC

InChI

InChI=1S/C14H16N2O4/c1-5-10-13(14(17)20-4)16(19)12-7-9(3)8(2)6-11(12)15(10)18/h6-7H,5H2,1-4H3