methyl 6,7-bis(chloranyl)-3-(2-methoxyethyl)-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxylate

Systemtic Name: methyl 6,7-bis(chloranyl)-3-(2-methoxyethyl)-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxylate Openeye Name: methyl 6,7-dichloro-3-(2-methoxyethyl)-4-oxido-1-oxo-quinoxalin-1-ium-2-carboxylate CAS Name: 6,7-dichloro-3-(2-methoxyethyl)-4-oxido-1-oxo-2-quinoxalin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 6,7-dichloro-3-(2-methoxyethyl)-4-oxido-1-oxoquinoxalin-1-ium-2-carboxylate Traditional Name: 6,7-dichloro-1-keto-3-(2-methoxyethyl)-4-oxido-quinoxalin-1-ium-2-carboxylic acid methyl ester Formula: C13H12Cl2N2O5 MolecularWeight: 347.15078

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Descriptors Computed from Structure

Canonical SMILES:

COCCC1=C([N+](=O)C2=CC(=C(C=C2N1[O-])Cl)Cl)C(=O)OC

Isomeric SMILES

COCCC1=C([N+](=O)C2=CC(=C(C=C2N1[O-])Cl)Cl)C(=O)OC

InChI

InChI=1S/C13H12Cl2N2O5/c1-21-4-3-9-12(13(18)22-2)17(20)11-6-8(15)7(14)5-10(11)16(9)19/h5-6H,3-4H2,1-2H3