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

Systemtic Name: 2-(3,5-dimethyl-4-oxidanyl-phenyl)-2-sulfanyl-ethanoic acid Openeye Name: 2-(4-hydroxy-3,5-dimethyl-phenyl)-2-sulfanyl-acetic acid CAS Name: 2-(4-hydroxy-3,5-dimethylphenyl)-2-mercaptoacetic acid IUPAC Name: 2-(4-hydroxy-3,5-dimethylphenyl)-2-sulfanylacetic acid Traditional Name: 2-(4-hydroxy-3,5-dimethyl-phenyl)-2-mercapto-acetic acid Formula: C10H12O3S MolecularWeight: 212.26548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C(C(=O)O)S

Isomeric SMILES

CC1=CC(=CC(=C1O)C)C(C(=O)O)S

InChI

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