[3-(trifluoromethyl)phenyl] methylsulfonylmethanesulfonate

Systemtic Name: [3-(trifluoromethyl)phenyl] methylsulfonylmethanesulfonate Openeye Name: [3-(trifluoromethyl)phenyl] methylsulfonylmethanesulfonate CAS Name: methylsulfonylmethanesulfonic acid [3-(trifluoromethyl)phenyl] ester IUPAC Name: [3-(trifluoromethyl)phenyl] methylsulfonylmethanesulfonate Traditional Name: mesylmethanesulfonic acid [3-(trifluoromethyl)phenyl] ester Formula: C9H9F3O5S2 MolecularWeight: 318.28997

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CS(=O)(=O)OC1=CC=CC(=C1)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)CS(=O)(=O)OC1=CC=CC(=C1)C(F)(F)F

InChI

InChI=1S/C9H9F3O5S2/c1-18(13,14)6-19(15,16)17-8-4-2-3-7(5-8)9(10,11)12/h2-5H,6H2,1H3