methyl 2-[2-(4-methylsulfonylphenyl)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: methyl 2-[2-(4-methylsulfonylphenyl)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: methyl 2-[2-(4-methylsulfonylphenyl)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(4-methylsulfonylphenyl)-2-oxoethyl]thio]benzoic acid methyl ester IUPAC Name: methyl 2-[2-(4-methylsulfonylphenyl)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-keto-2-(4-mesylphenyl)ethyl]thio]benzoic acid methyl ester Formula: C17H16O5S2 MolecularWeight: 364.43594

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1SCC(=O)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC=CC=C1SCC(=O)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C17H16O5S2/c1-22-17(19)14-5-3-4-6-16(14)23-11-15(18)12-7-9-13(10-8-12)24(2,20)21/h3-10H,11H2,1-2H3