2-[4-(2-ethanoylsulfanylphenyl)phenyl]-2-oxidanyl-propanoic acid

Systemtic Name: 2-[4-(2-ethanoylsulfanylphenyl)phenyl]-2-oxidanyl-propanoic acid Openeye Name: 2-[4-(2-acetylsulfanylphenyl)phenyl]-2-hydroxy-propanoic acid CAS Name: 2-[4-[2-(acetylthio)phenyl]phenyl]-2-hydroxypropanoic acid IUPAC Name: 2-[4-(2-acetylsulfanylphenyl)phenyl]-2-hydroxypropanoic acid Traditional Name: 2-[4-[2-(acetylthio)phenyl]phenyl]-2-hydroxy-propionic acid Formula: C17H16O4S MolecularWeight: 316.37154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16O4S/c1-11(18)22-15-6-4-3-5-14(15)12-7-9-13(10-8-12)17(2,21)16(19)20/h3-10,21H,1-2H3,(H,19,20)