dimethyl 2-chloranyl-2-(4-methylphenyl)sulfonylsulfanyl-propanedioate

Systemtic Name: dimethyl 2-chloranyl-2-(4-methylphenyl)sulfonylsulfanyl-propanedioate Openeye Name: dimethyl 2-chloro-2-(p-tolylsulfonylsulfanyl)propanedioate CAS Name: 2-chloro-2-[(4-methylphenyl)sulfonylthio]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-chloro-2-(4-methylphenyl)sulfonylsulfanylpropanedioate Traditional Name: 2-chloro-2-(tosylthio)malonic acid dimethyl ester Formula: C12H13ClO6S2 MolecularWeight: 352.81102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)SC(C(=O)OC)(C(=O)OC)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)SC(C(=O)OC)(C(=O)OC)Cl

InChI

InChI=1S/C12H13ClO6S2/c1-8-4-6-9(7-5-8)21(16,17)20-12(13,10(14)18-2)11(15)19-3/h4-7H,1-3H3