3-[2-(4-propoxyphenoxy)ethylsulfanyl]propanoic acid

Systemtic Name: 3-[2-(4-propoxyphenoxy)ethylsulfanyl]propanoic acid Openeye Name: 3-[2-(4-propoxyphenoxy)ethylsulfanyl]propanoic acid CAS Name: 3-[2-(4-propoxyphenoxy)ethylthio]propanoic acid IUPAC Name: 3-[2-(4-propoxyphenoxy)ethylsulfanyl]propanoic acid Traditional Name: 3-[2-(4-propoxyphenoxy)ethylthio]propionic acid Formula: C14H20O4S MolecularWeight: 284.3712

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)OCCSCCC(=O)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)OCCSCCC(=O)O

InChI

InChI=1S/C14H20O4S/c1-2-8-17-12-3-5-13(6-4-12)18-9-11-19-10-7-14(15)16/h3-6H,2,7-11H2,1H3,(H,15,16)