(3-fluorophenyl) 4-methylsulfonylbenzenesulfonate

Systemtic Name: (3-fluorophenyl) 4-methylsulfonylbenzenesulfonate Openeye Name: (3-fluorophenyl) 4-methylsulfonylbenzenesulfonate CAS Name: 4-methylsulfonylbenzenesulfonic acid (3-fluorophenyl) ester IUPAC Name: (3-fluorophenyl) 4-methylsulfonylbenzenesulfonate Traditional Name: 4-mesylbenzenesulfonic acid (3-fluorophenyl) ester Formula: C13H11FO5S2 MolecularWeight: 330.351843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)OC2=CC(=CC=C2)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)OC2=CC(=CC=C2)F

InChI

InChI=1S/C13H11FO5S2/c1-20(15,16)12-5-7-13(8-6-12)21(17,18)19-11-4-2-3-10(14)9-11/h2-9H,1H3