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

Systemtic Name: 3-[2-(4-methoxyphenyl)ethylsulfanyl]propanoic acid Openeye Name: 3-[2-(4-methoxyphenyl)ethylsulfanyl]propanoic acid CAS Name: 3-[2-(4-methoxyphenyl)ethylthio]propanoic acid IUPAC Name: 3-[2-(4-methoxyphenyl)ethylsulfanyl]propanoic acid Traditional Name: 3-[2-(4-methoxyphenyl)ethylthio]propionic acid Formula: C12H16O3S MolecularWeight: 240.31864

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCSCCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CCSCCC(=O)O

InChI

InChI=1S/C12H16O3S/c1-15-11-4-2-10(3-5-11)6-8-16-9-7-12(13)14/h2-5H,6-9H2,1H3,(H,13,14)