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

Systemtic Name: 3-[3-(4-ethoxyphenoxy)-2-oxidanylidene-propyl]sulfanylpropanoic acid Openeye Name: 3-[3-(4-ethoxyphenoxy)-2-oxo-propyl]sulfanylpropanoic acid CAS Name: 3-[[3-(4-ethoxyphenoxy)-2-oxopropyl]thio]propanoic acid IUPAC Name: 3-[3-(4-ethoxyphenoxy)-2-oxopropyl]sulfanylpropanoic acid Traditional Name: 3-[[3-(4-ethoxyphenoxy)-2-keto-propyl]thio]propionic acid Formula: C14H18O5S MolecularWeight: 298.35472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18O5S/c1-2-18-12-3-5-13(6-4-12)19-9-11(15)10-20-8-7-14(16)17/h3-6H,2,7-10H2,1H3,(H,16,17)