[3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxol-1-yl] methanesulfonate

Systemtic Name: [3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxol-1-yl] methanesulfonate Openeye Name: [3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxol-1-yl] methanesulfonate CAS Name: methanesulfonic acid [3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxol-1-yl] ester IUPAC Name: [3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxol-1-yl] methanesulfonate Traditional Name: methanesulfonic acid [3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxol-1-yl] ester Formula: C10H7F6IO4S MolecularWeight: 464.120069

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OI1C2=CC=CC=C2C(O1)(C(F)(F)F)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)OI1C2=CC=CC=C2C(O1)(C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C10H7F6IO4S/c1-22(18,19)21-17-7-5-3-2-4-6(7)8(20-17,9(11,12)13)10(14,15)16/h2-5H,1H3