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

Systemtic Name: 4-azanyl-4-oxidanylidene-2-[(2-oxidanyl-2-phenyl-ethanoyl)amino]butanoic acid Openeye Name: 4-amino-2-[(2-hydroxy-2-phenyl-acetyl)amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[(2-hydroxy-1-oxo-2-phenylethyl)amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[(2-hydroxy-2-phenylacetyl)amino]-4-oxobutanoic acid Traditional Name: 4-amino-4-keto-2-(mandeloylamino)butyric acid Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O5/c13-9(15)6-8(12(18)19)14-11(17)10(16)7-4-2-1-3-5-7/h1-5,8,10,16H,6H2,(H2,13,15)(H,14,17)(H,18,19)