2-acetamido-2-(3-oxidanylidene-3-phenyl-propyl)propanedioic acid

Systemtic Name: 2-acetamido-2-(3-oxidanylidene-3-phenyl-propyl)propanedioic acid Openeye Name: 2-acetamido-2-(3-oxo-3-phenyl-propyl)propanedioic acid CAS Name: 2-acetamido-2-(3-oxo-3-phenylpropyl)propanedioic acid IUPAC Name: 2-acetamido-2-(3-oxo-3-phenylpropyl)propanedioic acid Traditional Name: 2-acetamido-2-(3-keto-3-phenyl-propyl)malonic acid Formula: C14H15NO6 MolecularWeight: 293.272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15NO6/c1-9(16)15-14(12(18)19,13(20)21)8-7-11(17)10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,15,16)(H,18,19)(H,20,21)