3-[2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-(2,4-dimethoxyphenyl)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-(2,4-dimethoxyphenyl)-2-oxoethyl]thio]propanoic acid IUPAC Name: 3-[2-(2,4-dimethoxyphenyl)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 3-[[2-(2,4-dimethoxyphenyl)-2-keto-ethyl]thio]propionic acid Formula: C13H16O5S MolecularWeight: 284.32814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O5S/c1-17-9-3-4-10(12(7-9)18-2)11(14)8-19-6-5-13(15)16/h3-4,7H,5-6,8H2,1-2H3,(H,15,16)