2-[2-(3-ethanoylsulfanyl-2-phenyl-propanoyl)phenyl]-2-oxidanyl-ethanoic acid

Systemtic Name: 2-[2-(3-ethanoylsulfanyl-2-phenyl-propanoyl)phenyl]-2-oxidanyl-ethanoic acid Openeye Name: 2-[2-(3-acetylsulfanyl-2-phenyl-propanoyl)phenyl]-2-hydroxy-acetic acid CAS Name: 2-[2-[3-(acetylthio)-1-oxo-2-phenylpropyl]phenyl]-2-hydroxyacetic acid IUPAC Name: 2-[2-(3-acetylsulfanyl-2-phenylpropanoyl)phenyl]-2-hydroxyacetic acid Traditional Name: 2-[2-[3-(acetylthio)-2-phenyl-propanoyl]phenyl]-2-hydroxy-acetic acid Formula: C19H18O5S MolecularWeight: 358.40822

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2C(C(=O)O)O

Isomeric SMILES

CC(=O)SCC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2C(C(=O)O)O

InChI

InChI=1S/C19H18O5S/c1-12(20)25-11-16(13-7-3-2-4-8-13)17(21)14-9-5-6-10-15(14)18(22)19(23)24/h2-10,16,18,22H,11H2,1H3,(H,23,24)