[4-(3-methyl-3-oxidanyl-but-1-ynyl)phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: [4-(3-methyl-3-oxidanyl-but-1-ynyl)phenyl] tris(fluoranyl)methanesulfonate Openeye Name: [4-(3-hydroxy-3-methyl-but-1-ynyl)phenyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [4-(3-hydroxy-3-methylbut-1-ynyl)phenyl] ester IUPAC Name: [4-(3-hydroxy-3-methylbut-1-ynyl)phenyl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [4-(3-hydroxy-3-methyl-but-1-ynyl)phenyl] ester Formula: C12H11F3O4S MolecularWeight: 308.27355

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F)O

Isomeric SMILES

CC(C)(C#CC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F)O

InChI

InChI=1S/C12H11F3O4S/c1-11(2,16)8-7-9-3-5-10(6-4-9)19-20(17,18)12(13,14)15/h3-6,16H,1-2H3