3-methoxy-4-sulfanyl-benzoic acid

Systemtic Name: 3-methoxy-4-sulfanyl-benzoic acid Openeye Name: 3-methoxy-4-sulfanyl-benzoic acid CAS Name: 4-mercapto-3-methoxybenzoic acid IUPAC Name: 3-methoxy-4-sulfanylbenzoic acid Traditional Name: 4-mercapto-3-methoxy-benzoic acid Formula: C8H8O3S MolecularWeight: 184.21232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)O)S

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)O)S

InChI

InChI=1S/C8H8O3S/c1-11-6-4-5(8(9)10)2-3-7(6)12/h2-4,12H,1H3,(H,9,10)