3-methyl-2-methylsulfonyl-3-phenyl-butanoic acid

Systemtic Name: 3-methyl-2-methylsulfonyl-3-phenyl-butanoic acid Openeye Name: 3-methyl-2-methylsulfonyl-3-phenyl-butanoic acid CAS Name: 3-methyl-2-methylsulfonyl-3-phenylbutanoic acid IUPAC Name: 3-methyl-2-methylsulfonyl-3-phenylbutanoic acid Traditional Name: 2-mesyl-3-methyl-3-phenyl-butyric acid Formula: C12H16O4S MolecularWeight: 256.31804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C(C(=O)O)S(=O)(=O)C

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C(C(=O)O)S(=O)(=O)C

InChI

InChI=1S/C12H16O4S/c1-12(2,9-7-5-4-6-8-9)10(11(13)14)17(3,15)16/h4-8,10H,1-3H3,(H,13,14)