methyl 4-[(E)-2-methylsulfanyl-2-methylsulfinyl-ethenyl]benzoate

Systemtic Name: methyl 4-[(E)-2-methylsulfanyl-2-methylsulfinyl-ethenyl]benzoate Openeye Name: methyl 4-[(E)-2-methylsulfanyl-2-methylsulfinyl-vinyl]benzoate CAS Name: 4-[(E)-2-methylsulfinyl-2-(methylthio)ethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]benzoate Traditional Name: 4-[(E)-2-methylsulfinyl-2-(methylthio)vinyl]benzoic acid methyl ester Formula: C12H14O3S2 MolecularWeight: 270.36776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C(\SC)/S(=O)C

InChI

InChI=1S/C12H14O3S2/c1-15-12(13)10-6-4-9(5-7-10)8-11(16-2)17(3)14/h4-8H,1-3H3/b11-8+