ethyl 7-methoxy-3-methyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxylate

Systemtic Name: ethyl 7-methoxy-3-methyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxylate Openeye Name: ethyl 7-methoxy-3-methyl-4-oxido-1-oxo-quinoxalin-1-ium-2-carboxylate CAS Name: 7-methoxy-3-methyl-4-oxido-1-oxo-2-quinoxalin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 7-methoxy-3-methyl-4-oxido-1-oxoquinoxalin-1-ium-2-carboxylate Traditional Name: 1-keto-7-methoxy-3-methyl-4-oxido-quinoxalin-1-ium-2-carboxylic acid ethyl ester Formula: C13H14N2O5 MolecularWeight: 278.26066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C([N+]1=O)C=C(C=C2)OC)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C([N+]1=O)C=C(C=C2)OC)[O-])C

InChI

InChI=1S/C13H14N2O5/c1-4-20-13(16)12-8(2)14(17)10-6-5-9(19-3)7-11(10)15(12)18/h5-7H,4H2,1-3H3