1-[7-chloranyl-4-oxidanidyl-1-oxidanylidene-3-(trifluoromethyl)quinoxalin-1-ium-2-yl]ethanone

Systemtic Name: 1-[7-chloranyl-4-oxidanidyl-1-oxidanylidene-3-(trifluoromethyl)quinoxalin-1-ium-2-yl]ethanone Openeye Name: 1-[7-chloro-4-oxido-1-oxo-3-(trifluoromethyl)quinoxalin-1-ium-2-yl]ethanone CAS Name: 1-[7-chloro-4-oxido-1-oxo-3-(trifluoromethyl)-2-quinoxalin-1-iumyl]ethanone IUPAC Name: 1-[7-chloro-4-oxido-1-oxo-3-(trifluoromethyl)quinoxalin-1-ium-2-yl]ethanone Traditional Name: 1-[7-chloro-1-keto-4-oxido-3-(trifluoromethyl)quinoxalin-1-ium-2-yl]ethanone Formula: C11H6ClF3N2O3 MolecularWeight: 306.62515

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H6ClF3N2O3/c1-5(18)9-10(11(13,14)15)17(20)7-3-2-6(12)4-8(7)16(9)19/h2-4H,1H3