methyl 3-[1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]sulfanylpropanoate

Systemtic Name: methyl 3-[1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]sulfanylpropanoate Openeye Name: methyl 3-[1-methyl-2-oxo-2-(p-tolyl)ethyl]sulfanylpropanoate CAS Name: 3-[[1-(4-methylphenyl)-1-oxopropan-2-yl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[1-(4-methylphenyl)-1-oxopropan-2-yl]sulfanylpropanoate Traditional Name: 3-[[2-keto-1-methyl-2-(p-tolyl)ethyl]thio]propionic acid methyl ester Formula: C14H18O3S MolecularWeight: 266.35592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)SCCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C)SCCC(=O)OC

InChI

InChI=1S/C14H18O3S/c1-10-4-6-12(7-5-10)14(16)11(2)18-9-8-13(15)17-3/h4-7,11H,8-9H2,1-3H3