3,5-bis(methylsulfanyl)-2-oxidanyl-benzoate

Systemtic Name: 3,5-bis(methylsulfanyl)-2-oxidanyl-benzoate Openeye Name: 2-hydroxy-3,5-bis(methylsulfanyl)benzoate CAS Name: 2-hydroxy-3,5-bis(methylthio)benzoate IUPAC Name: 2-hydroxy-3,5-bis(methylsulfanyl)benzoate Traditional Name: 2-hydroxy-3,5-bis(methylthio)benzoate Formula: C9H9O3S2- MolecularWeight: 229.29596

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C(=C1)C(=O)[O-])O)SC

Isomeric SMILES

CSC1=CC(=C(C(=C1)C(=O)[O-])O)SC

InChI

InChI=1S/C9H10O3S2/c1-13-5-3-6(9(11)12)8(10)7(4-5)14-2/h3-4,10H,1-2H3,(H,11,12)/p-1