methyl 3-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanylpropanoate

Systemtic Name: methyl 3-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: methyl 3-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanylpropanoate Traditional Name: 3-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]propionic acid methyl ester Formula: C13H16O4S MolecularWeight: 268.32874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O4S/c1-16-11-5-3-10(4-6-11)12(14)9-18-8-7-13(15)17-2/h3-6H,7-9H2,1-2H3