2-[(2-oxidanyl-2-oxidanylidene-1-phenyl-ethyl)amino]propanedioic acid

Systemtic Name: 2-[(2-oxidanyl-2-oxidanylidene-1-phenyl-ethyl)amino]propanedioic acid Openeye Name: 2-[(2-hydroxy-2-oxo-1-phenyl-ethyl)amino]propanedioic acid CAS Name: 2-[(2-hydroxy-2-oxo-1-phenylethyl)amino]propanedioic acid IUPAC Name: 2-[(2-hydroxy-2-oxo-1-phenylethyl)amino]propanedioic acid Traditional Name: 2-[(2-hydroxy-2-keto-1-phenyl-ethyl)amino]malonic acid Formula: C11H11NO6 MolecularWeight: 253.20814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO6/c13-9(14)7(6-4-2-1-3-5-6)12-8(10(15)16)11(17)18/h1-5,7-8,12H,(H,13,14)(H,15,16)(H,17,18)