methyl 4-(4-methoxyphenyl)sulfonyl-2-sulfanyl-butanoate

Systemtic Name: methyl 4-(4-methoxyphenyl)sulfonyl-2-sulfanyl-butanoate Openeye Name: methyl 4-(4-methoxyphenyl)sulfonyl-2-sulfanyl-butanoate CAS Name: 2-mercapto-4-(4-methoxyphenyl)sulfonylbutanoic acid methyl ester IUPAC Name: methyl 4-(4-methoxyphenyl)sulfonyl-2-sulfanylbutanoate Traditional Name: 2-mercapto-4-(4-methoxyphenyl)sulfonyl-butyric acid methyl ester Formula: C12H16O5S2 MolecularWeight: 304.38244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)CCC(C(=O)OC)S

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)CCC(C(=O)OC)S

InChI

InChI=1S/C12H16O5S2/c1-16-9-3-5-10(6-4-9)19(14,15)8-7-11(18)12(13)17-2/h3-6,11,18H,7-8H2,1-2H3