1-oxidanidyl-4-oxidanylidene-7-(trifluoromethyl)-3-[4-(trifluoromethyloxy)phenyl]quinoxalin-4-ium-2-carbonitrile

Systemtic Name: 1-oxidanidyl-4-oxidanylidene-7-(trifluoromethyl)-3-[4-(trifluoromethyloxy)phenyl]quinoxalin-4-ium-2-carbonitrile Openeye Name: 1-oxido-4-oxo-3-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)quinoxalin-4-ium-2-carbonitrile CAS Name: 1-oxido-4-oxo-3-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-2-quinoxalin-4-iumcarbonitrile IUPAC Name: 1-oxido-4-oxo-3-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)quinoxalin-4-ium-2-carbonitrile Traditional Name: 4-keto-1-oxido-3-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)quinoxalin-4-ium-2-carbonitrile Formula: C17H7F6N3O3 MolecularWeight: 415.246199

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(N(C3=C([N+]2=O)C=CC(=C3)C(F)(F)F)[O-])C#N)OC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C2=C(N(C3=C([N+]2=O)C=CC(=C3)C(F)(F)F)[O-])C#N)OC(F)(F)F

InChI

InChI=1S/C17H7F6N3O3/c18-16(19,20)10-3-6-12-13(7-10)25(27)14(8-24)15(26(12)28)9-1-4-11(5-2-9)29-17(21,22)23/h1-7H