3-ethanoyl-1-oxidanyl-4-oxidanylidene-quinoxalin-4-ium-2-carboxylate

Systemtic Name: 3-ethanoyl-1-oxidanyl-4-oxidanylidene-quinoxalin-4-ium-2-carboxylate Openeye Name: 3-acetyl-1-hydroxy-4-oxo-quinoxalin-4-ium-2-carboxylate CAS Name: 3-acetyl-1-hydroxy-4-oxo-2-quinoxalin-4-iumcarboxylate IUPAC Name: 3-acetyl-1-hydroxy-4-oxoquinoxalin-4-ium-2-carboxylate Traditional Name: 3-acetyl-1-hydroxy-4-keto-quinoxalin-4-ium-2-carboxylate Formula: C11H8N2O5 MolecularWeight: 248.19162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H8N2O5/c1-6(14)9-10(11(15)16)13(18)8-5-3-2-4-7(8)12(9)17/h2-5,18H,1H3