6,7-bis(chloranyl)-4-oxidanidyl-1-oxidanylidene-3-[4-(trifluoromethyloxy)phenyl]quinoxalin-1-ium-2-carbonitrile

Systemtic Name: 6,7-bis(chloranyl)-4-oxidanidyl-1-oxidanylidene-3-[4-(trifluoromethyloxy)phenyl]quinoxalin-1-ium-2-carbonitrile Openeye Name: 6,7-dichloro-4-oxido-1-oxo-3-[4-(trifluoromethoxy)phenyl]quinoxalin-1-ium-2-carbonitrile CAS Name: 6,7-dichloro-4-oxido-1-oxo-3-[4-(trifluoromethoxy)phenyl]-2-quinoxalin-1-iumcarbonitrile IUPAC Name: 6,7-dichloro-4-oxido-1-oxo-3-[4-(trifluoromethoxy)phenyl]quinoxalin-1-ium-2-carbonitrile Traditional Name: 6,7-dichloro-1-keto-4-oxido-3-[4-(trifluoromethoxy)phenyl]quinoxalin-1-ium-2-carbonitrile Formula: C16H6Cl2F3N3O3 MolecularWeight: 416.13835

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C([N+](=O)C3=CC(=C(C=C3N2[O-])Cl)Cl)C#N)OC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C2=C([N+](=O)C3=CC(=C(C=C3N2[O-])Cl)Cl)C#N)OC(F)(F)F

InChI

InChI=1S/C16H6Cl2F3N3O3/c17-10-5-12-13(6-11(10)18)24(26)15(14(7-22)23(12)25)8-1-3-9(4-2-8)27-16(19,20)21/h1-6H