[4-[(2R)-2,4-dimethyl-3-methylsulfonyloxy-5-oxidanylidene-thiophen-2-yl]-3-methyl-butyl] methanesulfonate

Systemtic Name: [4-[(2R)-2,4-dimethyl-3-methylsulfonyloxy-5-oxidanylidene-thiophen-2-yl]-3-methyl-butyl] methanesulfonate Openeye Name: [4-[(2R)-2,4-dimethyl-3-methylsulfonyloxy-5-oxo-2-thienyl]-3-methyl-butyl] methanesulfonate CAS Name: methanesulfonic acid [4-[(2R)-2,4-dimethyl-3-methylsulfonyloxy-5-oxo-2-thiophenyl]-3-methylbutyl] ester IUPAC Name: [4-[(2R)-2,4-dimethyl-3-methylsulfonyloxy-5-oxothiophen-2-yl]-3-methylbutyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[(2R)-5-keto-2,4-dimethyl-3-methylsulfonyloxy-2-thienyl]-3-methyl-butyl] ester Formula: C13H22O7S3 MolecularWeight: 386.50458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(SC1=O)(C)CC(C)CCOS(=O)(=O)C)OS(=O)(=O)C

Isomeric SMILES

CC1=C([C@@](SC1=O)(C)CC(C)CCOS(=O)(=O)C)OS(=O)(=O)C

InChI

InChI=1S/C13H22O7S3/c1-9(6-7-19-22(4,15)16)8-13(3)11(20-23(5,17)18)10(2)12(14)21-13/h9H,6-8H2,1-5H3/t9?,13-/m1/s1