3-(4-acetamidophenyl)sulfanylpropanoic acid

Systemtic Name: 3-(4-acetamidophenyl)sulfanylpropanoic acid Openeye Name: 3-(4-acetamidophenyl)sulfanylpropanoic acid CAS Name: 3-[(4-acetamidophenyl)thio]propanoic acid IUPAC Name: 3-(4-acetamidophenyl)sulfanylpropanoic acid Traditional Name: 3-[(4-acetamidophenyl)thio]propionic acid Formula: C11H13NO3S MolecularWeight: 239.29082

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCCC(=O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCCC(=O)O

InChI

InChI=1S/C11H13NO3S/c1-8(13)12-9-2-4-10(5-3-9)16-7-6-11(14)15/h2-5H,6-7H2,1H3,(H,12,13)(H,14,15)