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

Systemtic Name: methyl 3-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: methyl 3-[2-(3,4-dimethylphenyl)-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-(3,4-dimethylphenyl)-2-oxoethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(3,4-dimethylphenyl)-2-oxoethyl]sulfanylpropanoate Traditional Name: 3-[[2-(3,4-dimethylphenyl)-2-keto-ethyl]thio]propionic acid methyl ester Formula: C14H18O3S MolecularWeight: 266.35592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CSCCC(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CSCCC(=O)OC)C

InChI

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