2-(2,6-dimethyl-4-sulfanyl-phenoxy)ethanoic acid

Systemtic Name: 2-(2,6-dimethyl-4-sulfanyl-phenoxy)ethanoic acid Openeye Name: 2-(2,6-dimethyl-4-sulfanyl-phenoxy)acetic acid CAS Name: 2-(4-mercapto-2,6-dimethylphenoxy)acetic acid IUPAC Name: 2-(2,6-dimethyl-4-sulfanylphenoxy)acetic acid Traditional Name: 2-(4-mercapto-2,6-dimethyl-phenoxy)acetic acid Formula: C10H12O3S MolecularWeight: 212.26548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)O)C)S

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)O)C)S

InChI

InChI=1S/C10H12O3S/c1-6-3-8(14)4-7(2)10(6)13-5-9(11)12/h3-4,14H,5H2,1-2H3,(H,11,12)