(2S)-3-oxidanyl-2-(4-phenylbutanoylamino)propanoate

Systemtic Name: (2S)-3-oxidanyl-2-(4-phenylbutanoylamino)propanoate Openeye Name: (2S)-3-hydroxy-2-(4-phenylbutanoylamino)propanoate CAS Name: (2S)-3-hydroxy-2-[(1-oxo-4-phenylbutyl)amino]propanoate IUPAC Name: (2S)-3-hydroxy-2-(4-phenylbutanoylamino)propanoate Traditional Name: (2S)-3-hydroxy-2-(4-phenylbutanoylamino)propionate Formula: C13H16NO4- MolecularWeight: 250.27044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(=O)NC(CO)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCCC(=O)N[C@@H](CO)C(=O)[O-]

InChI

InChI=1S/C13H17NO4/c15-9-11(13(17)18)14-12(16)8-4-7-10-5-2-1-3-6-10/h1-3,5-6,11,15H,4,7-9H2,(H,14,16)(H,17,18)/p-1/t11-/m0/s1