2-(3-methyl-4-oxidanyl-phenyl)sulfanylpropanoic acid

Systemtic Name: 2-(3-methyl-4-oxidanyl-phenyl)sulfanylpropanoic acid Openeye Name: 2-(4-hydroxy-3-methyl-phenyl)sulfanylpropanoic acid CAS Name: 2-[(4-hydroxy-3-methylphenyl)thio]propanoic acid IUPAC Name: 2-(4-hydroxy-3-methylphenyl)sulfanylpropanoic acid Traditional Name: 2-[(4-hydroxy-3-methyl-phenyl)thio]propionic acid Formula: C10H12O3S MolecularWeight: 212.26548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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