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

Systemtic Name: 6,7-dimethyl-4-oxidanidyl-1-oxidanylidene-3-[4-(trifluoromethyloxy)phenyl]quinoxalin-1-ium-2-carbonitrile Openeye Name: 6,7-dimethyl-4-oxido-1-oxo-3-[4-(trifluoromethoxy)phenyl]quinoxalin-1-ium-2-carbonitrile CAS Name: 6,7-dimethyl-4-oxido-1-oxo-3-[4-(trifluoromethoxy)phenyl]-2-quinoxalin-1-iumcarbonitrile IUPAC Name: 6,7-dimethyl-4-oxido-1-oxo-3-[4-(trifluoromethoxy)phenyl]quinoxalin-1-ium-2-carbonitrile Traditional Name: 1-keto-6,7-dimethyl-4-oxido-3-[4-(trifluoromethoxy)phenyl]quinoxalin-1-ium-2-carbonitrile Formula: C18H12F3N3O3 MolecularWeight: 375.30139

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)[N+](=O)C(=C(N2[O-])C3=CC=C(C=C3)OC(F)(F)F)C#N

Isomeric SMILES

CC1=CC2=C(C=C1C)[N+](=O)C(=C(N2[O-])C3=CC=C(C=C3)OC(F)(F)F)C#N

InChI

InChI=1S/C18H12F3N3O3/c1-10-7-14-15(8-11(10)2)24(26)17(16(9-22)23(14)25)12-3-5-13(6-4-12)27-18(19,20)21/h3-8H,1-2H3