2-methyl-2-(3-methylphenyl)sulfanyl-propanoic acid

Systemtic Name: 2-methyl-2-(3-methylphenyl)sulfanyl-propanoic acid Openeye Name: 2-methyl-2-(m-tolylsulfanyl)propanoic acid CAS Name: 2-methyl-2-[(3-methylphenyl)thio]propanoic acid IUPAC Name: 2-methyl-2-(3-methylphenyl)sulfanylpropanoic acid Traditional Name: 2-methyl-2-(m-tolylthio)propionic acid Formula: C11H14O2S MolecularWeight: 210.29266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14O2S/c1-8-5-4-6-9(7-8)14-11(2,3)10(12)13/h4-7H,1-3H3,(H,12,13)