2-(2,4,6-trimethylphenyl)sulfanylethanoic acid

Systemtic Name: 2-(2,4,6-trimethylphenyl)sulfanylethanoic acid Openeye Name: 2-(2,4,6-trimethylphenyl)sulfanylacetic acid CAS Name: 2-[(2,4,6-trimethylphenyl)thio]acetic acid IUPAC Name: 2-(2,4,6-trimethylphenyl)sulfanylacetic acid Traditional Name: 2-(mesitylthio)acetic acid Formula: C11H14O2S MolecularWeight: 210.29266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14O2S/c1-7-4-8(2)11(9(3)5-7)14-6-10(12)13/h4-5H,6H2,1-3H3,(H,12,13)