4,5-dimethyl-3-oxidanyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazol-3-ium

Systemtic Name: 4,5-dimethyl-3-oxidanyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazol-3-ium Openeye Name: 3-hydroxy-4,5-dimethyl-2-[4-(trifluoromethyl)phenyl]oxazol-3-ium CAS Name: 3-hydroxy-4,5-dimethyl-2-[4-(trifluoromethyl)phenyl]oxazol-3-ium IUPAC Name: 3-hydroxy-4,5-dimethyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazol-3-ium Traditional Name: 3-hydroxy-4,5-dimethyl-2-[4-(trifluoromethyl)phenyl]oxazol-3-ium Formula: C12H11F3NO2+ MolecularWeight: 258.21645

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=[N+]1O)C2=CC=C(C=C2)C(F)(F)F)C

Isomeric SMILES

CC1=C(OC(=[N+]1O)C2=CC=C(C=C2)C(F)(F)F)C

InChI

InChI=1S/C12H11F3NO2/c1-7-8(2)18-11(16(7)17)9-3-5-10(6-4-9)12(13,14)15/h3-6,17H,1-2H3/q+1