3-methyl-2-methylsulfanyl-3-phenyl-butanoic acid

Systemtic Name: 3-methyl-2-methylsulfanyl-3-phenyl-butanoic acid Openeye Name: 3-methyl-2-methylsulfanyl-3-phenyl-butanoic acid CAS Name: 3-methyl-2-(methylthio)-3-phenylbutanoic acid IUPAC Name: 3-methyl-2-methylsulfanyl-3-phenylbutanoic acid Traditional Name: 3-methyl-2-(methylthio)-3-phenyl-butyric acid Formula: C12H16O2S MolecularWeight: 224.31924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C(C(=O)O)SC

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C(C(=O)O)SC

InChI

InChI=1S/C12H16O2S/c1-12(2,10(15-3)11(13)14)9-7-5-4-6-8-9/h4-8,10H,1-3H3,(H,13,14)