2-[(2-oxidanyl-2-phenyl-ethanoyl)amino]butanoic acid

Systemtic Name: 2-[(2-oxidanyl-2-phenyl-ethanoyl)amino]butanoic acid Openeye Name: 2-[(2-hydroxy-2-phenyl-acetyl)amino]butanoic acid CAS Name: 2-[(2-hydroxy-1-oxo-2-phenylethyl)amino]butanoic acid IUPAC Name: 2-[(2-hydroxy-2-phenylacetyl)amino]butanoic acid Traditional Name: 2-(mandeloylamino)butyric acid Formula: C12H15NO4 MolecularWeight: 237.2518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C(C1=CC=CC=C1)O

Isomeric SMILES

CCC(C(=O)O)NC(=O)C(C1=CC=CC=C1)O

InChI

InChI=1S/C12H15NO4/c1-2-9(12(16)17)13-11(15)10(14)8-6-4-3-5-7-8/h3-7,9-10,14H,2H2,1H3,(H,13,15)(H,16,17)