3-oxidanyl-2-(4-phenylsulfanylbutanoylamino)propanoic acid

Systemtic Name: 3-oxidanyl-2-(4-phenylsulfanylbutanoylamino)propanoic acid Openeye Name: 3-hydroxy-2-(4-phenylsulfanylbutanoylamino)propanoic acid CAS Name: 3-hydroxy-2-[[1-oxo-4-(phenylthio)butyl]amino]propanoic acid IUPAC Name: 3-hydroxy-2-(4-phenylsulfanylbutanoylamino)propanoic acid Traditional Name: 3-hydroxy-2-[4-(phenylthio)butanoylamino]propionic acid Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCC(=O)NC(CO)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SCCCC(=O)NC(CO)C(=O)O

InChI

InChI=1S/C13H17NO4S/c15-9-11(13(17)18)14-12(16)7-4-8-19-10-5-2-1-3-6-10/h1-3,5-6,11,15H,4,7-9H2,(H,14,16)(H,17,18)