ethyl 7-bromanyl-3-methyl-4-oxidanidyl-quinoxalin-4-ium-2-carboxylate

Systemtic Name: ethyl 7-bromanyl-3-methyl-4-oxidanidyl-quinoxalin-4-ium-2-carboxylate Openeye Name: ethyl 7-bromo-3-methyl-4-oxido-quinoxalin-4-ium-2-carboxylate CAS Name: 7-bromo-3-methyl-4-oxido-2-quinoxalin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 7-bromo-3-methyl-4-oxidoquinoxalin-4-ium-2-carboxylate Traditional Name: 7-bromo-3-methyl-4-oxido-quinoxalin-4-ium-2-carboxylic acid ethyl ester Formula: C12H11BrN2O3 MolecularWeight: 311.13134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=C(C=CC(=C2)Br)[N+](=C1C)[O-]

Isomeric SMILES

CCOC(=O)C1=NC2=C(C=CC(=C2)Br)[N+](=C1C)[O-]

InChI

InChI=1S/C12H11BrN2O3/c1-3-18-12(16)11-7(2)15(17)10-5-4-8(13)6-9(10)14-11/h4-6H,3H2,1-2H3