4-(3-methyl-4-oxidanyl-1-oxidanylidene-quinoxalin-1-ium-2-yl)carbonylphenolate

Systemtic Name: 4-(3-methyl-4-oxidanyl-1-oxidanylidene-quinoxalin-1-ium-2-yl)carbonylphenolate Openeye Name: 4-(4-hydroxy-3-methyl-1-oxo-quinoxalin-1-ium-2-carbonyl)phenolate CAS Name: 4-[(4-hydroxy-3-methyl-1-oxo-2-quinoxalin-1-iumyl)-oxomethyl]phenolate IUPAC Name: 4-(4-hydroxy-3-methyl-1-oxoquinoxalin-1-ium-2-carbonyl)phenolate Traditional Name: 4-(4-hydroxy-1-keto-3-methyl-quinoxalin-1-ium-2-carbonyl)phenolate Formula: C16H12N2O4 MolecularWeight: 296.27748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=O)C2=CC=CC=C2N1O)C(=O)C3=CC=C(C=C3)[O-]

Isomeric SMILES

CC1=C([N+](=O)C2=CC=CC=C2N1O)C(=O)C3=CC=C(C=C3)[O-]

InChI

InChI=1S/C16H12N2O4/c1-10-15(16(20)11-6-8-12(19)9-7-11)18(22)14-5-3-2-4-13(14)17(10)21/h2-9,21H,1H3