methyl 3-oxidanyl-5-sulfanyl-benzoate

Systemtic Name: methyl 3-oxidanyl-5-sulfanyl-benzoate Openeye Name: methyl 3-hydroxy-5-sulfanyl-benzoate CAS Name: 3-hydroxy-5-mercaptobenzoic acid methyl ester IUPAC Name: methyl 3-hydroxy-5-sulfanylbenzoate Traditional Name: 3-hydroxy-5-mercapto-benzoic acid methyl ester Formula: C8H8O3S MolecularWeight: 184.21232

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)S)O

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)S)O

InChI

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