(phenylmethyl) 3-ethanoylsulfanyl-2-methyl-propanoate

Systemtic Name: (phenylmethyl) 3-ethanoylsulfanyl-2-methyl-propanoate Openeye Name: benzyl 3-acetylsulfanyl-2-methyl-propanoate CAS Name: 3-(acetylthio)-2-methylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-acetylsulfanyl-2-methylpropanoate Traditional Name: 3-(acetylthio)-2-methyl-propionic acid benzyl ester Formula: C13H16O3S MolecularWeight: 252.32934

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(CSC(=O)C)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C13H16O3S/c1-10(9-17-11(2)14)13(15)16-8-12-6-4-3-5-7-12/h3-7,10H,8-9H2,1-2H3