(4-methylsulfonyloxy-2-oxidanyl-3-phenylmethoxy-butyl) methanesulfonate

Systemtic Name: (4-methylsulfonyloxy-2-oxidanyl-3-phenylmethoxy-butyl) methanesulfonate Openeye Name: (3-benzyloxy-2-hydroxy-4-methylsulfonyloxy-butyl) methanesulfonate CAS Name: methanesulfonic acid (2-hydroxy-4-methylsulfonyloxy-3-phenylmethoxybutyl) ester IUPAC Name: (2-hydroxy-4-methylsulfonyloxy-3-phenylmethoxybutyl) methanesulfonate Traditional Name: methanesulfonic acid (3-benzoxy-2-hydroxy-4-methylsulfonyloxy-butyl) ester Formula: C13H20O8S2 MolecularWeight: 368.4231

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC(C(COS(=O)(=O)C)OCC1=CC=CC=C1)O

Isomeric SMILES

CS(=O)(=O)OCC(C(COS(=O)(=O)C)OCC1=CC=CC=C1)O

InChI

InChI=1S/C13H20O8S2/c1-22(15,16)20-9-12(14)13(10-21-23(2,17)18)19-8-11-6-4-3-5-7-11/h3-7,12-14H,8-10H2,1-2H3