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

Systemtic Name: 4-[methyl-(2-oxidanyl-2-phenyl-ethanoyl)amino]butanoic acid Openeye Name: 4-[(2-hydroxy-2-phenyl-acetyl)-methyl-amino]butanoic acid CAS Name: 4-[(2-hydroxy-1-oxo-2-phenylethyl)-methylamino]butanoic acid IUPAC Name: 4-[(2-hydroxy-2-phenylacetyl)-methylamino]butanoic acid Traditional Name: 4-[mandeloyl(methyl)amino]butyric acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)C(C1=CC=CC=C1)O

Isomeric SMILES

CN(CCCC(=O)O)C(=O)C(C1=CC=CC=C1)O

InChI

InChI=1S/C13H17NO4/c1-14(9-5-8-11(15)16)13(18)12(17)10-6-3-2-4-7-10/h2-4,6-7,12,17H,5,8-9H2,1H3,(H,15,16)