(2-methoxy-4-methylsulfanyl-phenyl)-oxidanyl-methanesulfonic acid

Systemtic Name: (2-methoxy-4-methylsulfanyl-phenyl)-oxidanyl-methanesulfonic acid Openeye Name: hydroxy-(2-methoxy-4-methylsulfanyl-phenyl)methanesulfonic acid CAS Name: hydroxy-[2-methoxy-4-(methylthio)phenyl]methanesulfonic acid IUPAC Name: hydroxy-(2-methoxy-4-methylsulfanylphenyl)methanesulfonic acid Traditional Name: hydroxy-[2-methoxy-4-(methylthio)phenyl]methanesulfonic acid Formula: C9H12O5S2 MolecularWeight: 264.31858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12O5S2/c1-14-8-5-6(15-2)3-4-7(8)9(10)16(11,12)13/h3-5,9-10H,1-2H3,(H,11,12,13)