5-azanyl-5-oxidanylidene-2-[(2-oxidanyl-2-phenyl-ethanoyl)amino]pentanoic acid

Systemtic Name: 5-azanyl-5-oxidanylidene-2-[(2-oxidanyl-2-phenyl-ethanoyl)amino]pentanoic acid Openeye Name: 5-amino-2-[(2-hydroxy-2-phenyl-acetyl)amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[(2-hydroxy-1-oxo-2-phenylethyl)amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[(2-hydroxy-2-phenylacetyl)amino]-5-oxopentanoic acid Traditional Name: 5-amino-5-keto-2-(mandeloylamino)valeric acid Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O5/c14-10(16)7-6-9(13(19)20)15-12(18)11(17)8-4-2-1-3-5-8/h1-5,9,11,17H,6-7H2,(H2,14,16)(H,15,18)(H,19,20)