[3-(hydroxymethyl)-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-yl]-phenyl-methanone

Systemtic Name: [3-(hydroxymethyl)-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-yl]-phenyl-methanone Openeye Name: [3-(hydroxymethyl)-4-oxido-1-oxo-quinoxalin-1-ium-2-yl]-phenyl-methanone CAS Name: [3-(hydroxymethyl)-4-oxido-1-oxo-2-quinoxalin-1-iumyl]-phenylmethanone IUPAC Name: [3-(hydroxymethyl)-4-oxido-1-oxoquinoxalin-1-ium-2-yl]-phenylmethanone Traditional Name: (1-keto-3-methylol-4-oxido-quinoxalin-1-ium-2-yl)-phenyl-methanone Formula: C16H12N2O4 MolecularWeight: 296.27748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(N(C3=CC=CC=C3[N+]2=O)[O-])CO

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(N(C3=CC=CC=C3[N+]2=O)[O-])CO

InChI

InChI=1S/C16H12N2O4/c19-10-14-15(16(20)11-6-2-1-3-7-11)18(22)13-9-5-4-8-12(13)17(14)21/h1-9,19H,10H2