methyl 3-(4-ethanoylphenyl)sulfanylpropanoate

Systemtic Name: methyl 3-(4-ethanoylphenyl)sulfanylpropanoate Openeye Name: methyl 3-(4-acetylphenyl)sulfanylpropanoate CAS Name: 3-[(4-acetylphenyl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-(4-acetylphenyl)sulfanylpropanoate Traditional Name: 3-[(4-acetylphenyl)thio]propionic acid methyl ester Formula: C12H14O3S MolecularWeight: 238.30276

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)SCCC(=O)OC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)SCCC(=O)OC

InChI

InChI=1S/C12H14O3S/c1-9(13)10-3-5-11(6-4-10)16-8-7-12(14)15-2/h3-6H,7-8H2,1-2H3