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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC(=O)CSCCC(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)OC(=O)CSCCC(=O)O

InChI

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