1-[3-methyl-4-oxidanidyl-1-oxidanylidene-6-(trifluoromethyl)quinoxalin-1-ium-2-yl]ethanone

Systemtic Name: 1-[3-methyl-4-oxidanidyl-1-oxidanylidene-6-(trifluoromethyl)quinoxalin-1-ium-2-yl]ethanone Openeye Name: 1-[3-methyl-4-oxido-1-oxo-6-(trifluoromethyl)quinoxalin-1-ium-2-yl]ethanone CAS Name: 1-[3-methyl-4-oxido-1-oxo-6-(trifluoromethyl)-2-quinoxalin-1-iumyl]ethanone IUPAC Name: 1-[3-methyl-4-oxido-1-oxo-6-(trifluoromethyl)quinoxalin-1-ium-2-yl]ethanone Traditional Name: 1-[1-keto-3-methyl-4-oxido-6-(trifluoromethyl)quinoxalin-1-ium-2-yl]ethanone Formula: C12H9F3N2O3 MolecularWeight: 286.20667

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=O)C2=C(N1[O-])C=C(C=C2)C(F)(F)F)C(=O)C

Isomeric SMILES

CC1=C([N+](=O)C2=C(N1[O-])C=C(C=C2)C(F)(F)F)C(=O)C

InChI

InChI=1S/C12H9F3N2O3/c1-6-11(7(2)18)17(20)9-4-3-8(12(13,14)15)5-10(9)16(6)19/h3-5H,1-2H3