methyl 3-(4-methoxyphenyl)-2-(methylsulfanylmethyl)-3-oxidanyl-propanoate

Systemtic Name: methyl 3-(4-methoxyphenyl)-2-(methylsulfanylmethyl)-3-oxidanyl-propanoate Openeye Name: methyl 3-hydroxy-3-(4-methoxyphenyl)-2-(methylsulfanylmethyl)propanoate CAS Name: 3-hydroxy-3-(4-methoxyphenyl)-2-[(methylthio)methyl]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-3-(4-methoxyphenyl)-2-(methylsulfanylmethyl)propanoate Traditional Name: 3-hydroxy-3-(4-methoxyphenyl)-2-[(methylthio)methyl]propionic acid methyl ester Formula: C13H18O4S MolecularWeight: 270.34462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C(CSC)C(=O)OC)O

Isomeric SMILES

COC1=CC=C(C=C1)C(C(CSC)C(=O)OC)O

InChI

InChI=1S/C13H18O4S/c1-16-10-6-4-9(5-7-10)12(14)11(8-18-3)13(15)17-2/h4-7,11-12,14H,8H2,1-3H3