3,3-dimethyl-2-(methylsulfonylmethyl)oxirane-2-carboxylic acid

Systemtic Name: 3,3-dimethyl-2-(methylsulfonylmethyl)oxirane-2-carboxylic acid Openeye Name: 3,3-dimethyl-2-(methylsulfonylmethyl)oxirane-2-carboxylic acid CAS Name: 3,3-dimethyl-2-(methylsulfonylmethyl)-2-oxiranecarboxylic acid IUPAC Name: 3,3-dimethyl-2-(methylsulfonylmethyl)oxirane-2-carboxylic acid Traditional Name: 2-(mesylmethyl)-3,3-dimethyl-oxirane-2-carboxylic acid Formula: C7H12O5S MolecularWeight: 208.23218

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(O1)(CS(=O)(=O)C)C(=O)O)C

Isomeric SMILES

CC1(C(O1)(CS(=O)(=O)C)C(=O)O)C

InChI

InChI=1S/C7H12O5S/c1-6(2)7(12-6,5(8)9)4-13(3,10)11/h4H2,1-3H3,(H,8,9)