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

Systemtic Name: [3-(hydroxymethyl)-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-yl]-(2-methylphenyl)methanone Openeye Name: [3-(hydroxymethyl)-4-oxido-1-oxo-quinoxalin-1-ium-2-yl]-(o-tolyl)methanone CAS Name: [3-(hydroxymethyl)-4-oxido-1-oxo-2-quinoxalin-1-iumyl]-(2-methylphenyl)methanone IUPAC Name: [3-(hydroxymethyl)-4-oxido-1-oxoquinoxalin-1-ium-2-yl]-(2-methylphenyl)methanone Traditional Name: (1-keto-3-methylol-4-oxido-quinoxalin-1-ium-2-yl)-(o-tolyl)methanone Formula: C17H14N2O4 MolecularWeight: 310.30406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C2=C(N(C3=CC=CC=C3[N+]2=O)[O-])CO

Isomeric SMILES

CC1=CC=CC=C1C(=O)C2=C(N(C3=CC=CC=C3[N+]2=O)[O-])CO

InChI

InChI=1S/C17H14N2O4/c1-11-6-2-3-7-12(11)17(21)16-15(10-20)18(22)13-8-4-5-9-14(13)19(16)23/h2-9,20H,10H2,1H3