2-[(4-ethoxyphenyl)methyl]-3-(phenylcarbonylsulfanyl)propanoic acid

Systemtic Name: 2-[(4-ethoxyphenyl)methyl]-3-(phenylcarbonylsulfanyl)propanoic acid Openeye Name: 2-(benzoylsulfanylmethyl)-3-(4-ethoxyphenyl)propanoic acid CAS Name: 2-[(benzoylthio)methyl]-3-(4-ethoxyphenyl)propanoic acid IUPAC Name: 2-(benzoylsulfanylmethyl)-3-(4-ethoxyphenyl)propanoic acid Traditional Name: 2-[(benzoylthio)methyl]-3-p-phenetyl-propionic acid Formula: C19H20O4S MolecularWeight: 344.4247

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC(CSC(=O)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)CC(CSC(=O)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C19H20O4S/c1-2-23-17-10-8-14(9-11-17)12-16(18(20)21)13-24-19(22)15-6-4-3-5-7-15/h3-11,16H,2,12-13H2,1H3,(H,20,21)