6-chloranyl-1-oxidanyl-4-oxidanylidene-quinoxalin-4-ium-2-carboxylate

Systemtic Name: 6-chloranyl-1-oxidanyl-4-oxidanylidene-quinoxalin-4-ium-2-carboxylate Openeye Name: 6-chloro-1-hydroxy-4-oxo-quinoxalin-4-ium-2-carboxylate CAS Name: 6-chloro-1-hydroxy-4-oxo-2-quinoxalin-4-iumcarboxylate IUPAC Name: 6-chloro-1-hydroxy-4-oxoquinoxalin-4-ium-2-carboxylate Traditional Name: 6-chloro-1-hydroxy-4-keto-quinoxalin-4-ium-2-carboxylate Formula: C9H5ClN2O4 MolecularWeight: 240.6

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)[N+](=O)C=C(N2O)C(=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1Cl)[N+](=O)C=C(N2O)C(=O)[O-]

InChI

InChI=1S/C9H5ClN2O4/c10-5-1-2-6-7(3-5)11(15)4-8(9(13)14)12(6)16/h1-4,16H