(phenylmethyl) 2-[4-(2-ethanoylsulfanylphenyl)phenyl]-2-oxidanyl-propanoate

Systemtic Name: (phenylmethyl) 2-[4-(2-ethanoylsulfanylphenyl)phenyl]-2-oxidanyl-propanoate Openeye Name: benzyl 2-[4-(2-acetylsulfanylphenyl)phenyl]-2-hydroxy-propanoate CAS Name: 2-[4-[2-(acetylthio)phenyl]phenyl]-2-hydroxypropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[4-(2-acetylsulfanylphenyl)phenyl]-2-hydroxypropanoate Traditional Name: 2-[4-[2-(acetylthio)phenyl]phenyl]-2-hydroxy-propionic acid benzyl ester Formula: C24H22O4S MolecularWeight: 406.49408

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1=CC=CC=C1C2=CC=C(C=C2)C(C)(C(=O)OCC3=CC=CC=C3)O

Isomeric SMILES

CC(=O)SC1=CC=CC=C1C2=CC=C(C=C2)C(C)(C(=O)OCC3=CC=CC=C3)O

InChI

InChI=1S/C24H22O4S/c1-17(25)29-22-11-7-6-10-21(22)19-12-14-20(15-13-19)24(2,27)23(26)28-16-18-8-4-3-5-9-18/h3-15,27H,16H2,1-2H3