2-(4-methylphenyl)sulfonylsulfanylethanoic acid

Systemtic Name: 2-(4-methylphenyl)sulfonylsulfanylethanoic acid Openeye Name: 2-(p-tolylsulfonylsulfanyl)acetic acid CAS Name: 2-[(4-methylphenyl)sulfonylthio]acetic acid IUPAC Name: 2-(4-methylphenyl)sulfonylsulfanylacetic acid Traditional Name: 2-(tosylthio)acetic acid Formula: C9H10O4S2 MolecularWeight: 246.3033

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)SCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)SCC(=O)O

InChI

InChI=1S/C9H10O4S2/c1-7-2-4-8(5-3-7)15(12,13)14-6-9(10)11/h2-5H,6H2,1H3,(H,10,11)