2-(3,5-dimethyl-4-sulfanyl-phenoxy)ethanoic acid

Systemtic Name: 2-(3,5-dimethyl-4-sulfanyl-phenoxy)ethanoic acid Openeye Name: 2-(3,5-dimethyl-4-sulfanyl-phenoxy)acetic acid CAS Name: 2-(4-mercapto-3,5-dimethylphenoxy)acetic acid IUPAC Name: 2-(3,5-dimethyl-4-sulfanylphenoxy)acetic acid Traditional Name: 2-(4-mercapto-3,5-dimethyl-phenoxy)acetic acid Formula: C10H12O3S MolecularWeight: 212.26548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S)C)OCC(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1S)C)OCC(=O)O

InChI

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