2-(3-phenylsulfanylpropanoylamino)ethanoic acid

Systemtic Name: 2-(3-phenylsulfanylpropanoylamino)ethanoic acid Openeye Name: 2-(3-phenylsulfanylpropanoylamino)acetic acid CAS Name: 2-[[1-oxo-3-(phenylthio)propyl]amino]acetic acid IUPAC Name: 2-(3-phenylsulfanylpropanoylamino)acetic acid Traditional Name: 2-[3-(phenylthio)propanoylamino]acetic acid Formula: C11H13NO3S MolecularWeight: 239.29082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO3S/c13-10(12-8-11(14)15)6-7-16-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,12,13)(H,14,15)