3-[2-oxidanylidene-2-(2-phenylpropylamino)ethyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-oxidanylidene-2-(2-phenylpropylamino)ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-oxo-2-(2-phenylpropylamino)ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-oxo-2-(2-phenylpropylamino)ethyl]thio]propanoic acid IUPAC Name: 3-[2-oxo-2-(2-phenylpropylamino)ethyl]sulfanylpropanoic acid Traditional Name: 3-[[2-keto-2-(2-phenylpropylamino)ethyl]thio]propionic acid Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)CSCCC(=O)O)C1=CC=CC=C1

Isomeric SMILES

CC(CNC(=O)CSCCC(=O)O)C1=CC=CC=C1

InChI

InChI=1S/C14H19NO3S/c1-11(12-5-3-2-4-6-12)9-15-13(16)10-19-8-7-14(17)18/h2-6,11H,7-10H2,1H3,(H,15,16)(H,17,18)