3,5-dimethyl-4-methylsulfanyl-2-oxidanyl-benzoic acid

Systemtic Name: 3,5-dimethyl-4-methylsulfanyl-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-3,5-dimethyl-4-methylsulfanyl-benzoic acid CAS Name: 2-hydroxy-3,5-dimethyl-4-(methylthio)benzoic acid IUPAC Name: 2-hydroxy-3,5-dimethyl-4-methylsulfanylbenzoic acid Traditional Name: 2-hydroxy-3,5-dimethyl-4-(methylthio)benzoic acid Formula: C10H12O3S MolecularWeight: 212.26548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12O3S/c1-5-4-7(10(12)13)8(11)6(2)9(5)14-3/h4,11H,1-3H3,(H,12,13)