4-[4-(trifluoromethyl)phenyl]-1,3,2-oxathiazol-1-ium-5-olate

Systemtic Name: 4-[4-(trifluoromethyl)phenyl]-1,3,2-oxathiazol-1-ium-5-olate Openeye Name: 4-[4-(trifluoromethyl)phenyl]-1,3,2-oxathiazol-1-ium-5-olate CAS Name: 4-[4-(trifluoromethyl)phenyl]-1,3,2-oxathiazol-1-ium-5-olate IUPAC Name: 4-[4-(trifluoromethyl)phenyl]-1,3,2-oxathiazol-1-ium-5-olate Traditional Name: 4-[4-(trifluoromethyl)phenyl]-1,3,2-oxathiazol-1-ium-5-olate Formula: C9H4F3NO2S MolecularWeight: 247.19377

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C([O+]=NS2)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C2=C([O+]=NS2)[O-])C(F)(F)F

InChI

InChI=1S/C9H4F3NO2S/c10-9(11,12)6-3-1-5(2-4-6)7-8(14)15-13-16-7/h1-4H