ethanoylsulfanylmethyl 3-phenylpropanoate

Systemtic Name: ethanoylsulfanylmethyl 3-phenylpropanoate Openeye Name: acetylsulfanylmethyl 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid (acetylthio)methyl ester IUPAC Name: acetylsulfanylmethyl 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid (acetylthio)methyl ester Formula: C12H14O3S MolecularWeight: 238.30276

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCOC(=O)CCC1=CC=CC=C1

Isomeric SMILES

CC(=O)SCOC(=O)CCC1=CC=CC=C1

InChI

InChI=1S/C12H14O3S/c1-10(13)16-9-15-12(14)8-7-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3