ethyl 3-(2-ethanoylsulfanylphenyl)propanoate

Systemtic Name: ethyl 3-(2-ethanoylsulfanylphenyl)propanoate Openeye Name: ethyl 3-(2-acetylsulfanylphenyl)propanoate CAS Name: 3-[2-(acetylthio)phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-(2-acetylsulfanylphenyl)propanoate Traditional Name: 3-[2-(acetylthio)phenyl]propionic acid ethyl ester Formula: C13H16O3S MolecularWeight: 252.32934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC=CC=C1SC(=O)C

Isomeric SMILES

CCOC(=O)CCC1=CC=CC=C1SC(=O)C

InChI

InChI=1S/C13H16O3S/c1-3-16-13(15)9-8-11-6-4-5-7-12(11)17-10(2)14/h4-7H,3,8-9H2,1-2H3