5-methyl-2-phenyl-[1,2,4]triazolo[4,3-a]pyridin-4-ium hexafluorophosphate

Systemtic Name: 5-methyl-2-phenyl-[1,2,4]triazolo[4,3-a]pyridin-4-ium hexafluorophosphate Openeye Name: 5-methyl-2-phenyl-[1,2,4]triazolo[4,3-a]pyridin-4-ium hexafluorophosphate CAS Name: 5-methyl-2-phenyl-[1,2,4]triazolo[4,3-a]pyridin-4-ium hexafluorophosphate IUPAC Name: 5-methyl-2-phenyl-[1,2,4]triazolo[4,3-a]pyridin-4-ium hexafluorophosphate Traditional Name: 5-methyl-2-phenyl-[1,2,4]triazolo[4,3-a]pyridin-4-ium hexafluorophosphate Formula: C13H12F6N3P MolecularWeight: 355.21866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=NN(C=[N+]12)C3=CC=CC=C3.F[P-](F)(F)(F)(F)F

Isomeric SMILES

CC1=CC=CC2=NN(C=[N+]12)C3=CC=CC=C3.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C13H12N3.F6P/c1-11-6-5-9-13-14-16(10-15(11)13)12-7-3-2-4-8-12;1-7(2,3,4,5)6/h2-10H,1H3;/q+1;-1