3-methylbutanoylsulfonyloxymethyl 3-methyl-1-oxidanylidene-butane-1-sulfonate

Systemtic Name: 3-methylbutanoylsulfonyloxymethyl 3-methyl-1-oxidanylidene-butane-1-sulfonate Openeye Name: 3-methylbutanoylsulfonyloxymethyl 3-methyl-1-oxo-butane-1-sulfonate CAS Name: 3-methyl-1-oxo-1-butanesulfonic acid IUPAC Name: 3-methylbutanoylsulfonyloxymethyl 3-methyl-1-oxobutane-1-sulfonate Traditional Name: 1-keto-3-methyl-butane-1-sulfonic acid isovalerylsulfonyloxymethyl ester Formula: C11H20O8S2 MolecularWeight: 344.4017

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)S(=O)(=O)OCOS(=O)(=O)C(=O)CC(C)C

Isomeric SMILES

CC(C)CC(=O)S(=O)(=O)OCOS(=O)(=O)C(=O)CC(C)C

InChI

InChI=1S/C11H20O8S2/c1-8(2)5-10(12)20(14,15)18-7-19-21(16,17)11(13)6-9(3)4/h8-9H,5-7H2,1-4H3