ethyl 3-azanylidene-2-cyano-1-oxidanidyl-4-oxidanyl-quinoxalin-1-ium-6-carboxylate

Systemtic Name: ethyl 3-azanylidene-2-cyano-1-oxidanidyl-4-oxidanyl-quinoxalin-1-ium-6-carboxylate Openeye Name: ethyl 2-cyano-4-hydroxy-3-imino-1-oxido-quinoxalin-1-ium-6-carboxylate CAS Name: 2-cyano-4-hydroxy-3-imino-1-oxido-6-quinoxalin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 2-cyano-4-hydroxy-3-imino-1-oxidoquinoxalin-1-ium-6-carboxylate Traditional Name: 2-cyano-4-hydroxy-3-imino-1-oxido-quinoxalin-1-ium-6-carboxylic acid ethyl ester Formula: C12H10N4O4 MolecularWeight: 274.2322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)[N+](=C(C(=N)N2O)C#N)[O-]

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)[N+](=C(C(=N)N2O)C#N)[O-]

InChI

InChI=1S/C12H10N4O4/c1-2-20-12(17)7-3-4-8-9(5-7)16(19)11(14)10(6-13)15(8)18/h3-5,14,19H,2H2,1H3