3-(2,4-dimethyl-6-methylsulfonyloxy-phenyl)-3-methyl-butanoic acid

Systemtic Name: 3-(2,4-dimethyl-6-methylsulfonyloxy-phenyl)-3-methyl-butanoic acid Openeye Name: 3-(2,4-dimethyl-6-methylsulfonyloxy-phenyl)-3-methyl-butanoic acid CAS Name: 3-(2,4-dimethyl-6-methylsulfonyloxyphenyl)-3-methylbutanoic acid IUPAC Name: 3-(2,4-dimethyl-6-methylsulfonyloxyphenyl)-3-methylbutanoic acid Traditional Name: 3-(2,4-dimethyl-6-methylsulfonyloxy-phenyl)-3-methyl-butyric acid Formula: C14H20O5S MolecularWeight: 300.3706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OS(=O)(=O)C)C(C)(C)CC(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OS(=O)(=O)C)C(C)(C)CC(=O)O)C

InChI

InChI=1S/C14H20O5S/c1-9-6-10(2)13(14(3,4)8-12(15)16)11(7-9)19-20(5,17)18/h6-7H,8H2,1-5H3,(H,15,16)