2-oxidanylidenepentanedioic acid; 2-phenylazanylpropanoic acid

Systemtic Name: 2-oxidanylidenepentanedioic acid; 2-phenylazanylpropanoic acid Openeye Name: 2-anilinopropanoic acid; 2-oxopentanedioic acid CAS Name: 2-anilinopropanoic acid; 2-oxopentanedioic acid IUPAC Name: 2-anilinopropanoic acid; 2-oxopentanedioic acid Traditional Name: 2-anilinopropionic acid; 2-ketoglutaric acid Formula: C14H17NO7 MolecularWeight: 311.28728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC1=CC=CC=C1.C(CC(=O)O)C(=O)C(=O)O

Isomeric SMILES

CC(C(=O)O)NC1=CC=CC=C1.C(CC(=O)O)C(=O)C(=O)O

InChI

InChI=1S/C9H11NO2.C5H6O5/c1-7(9(11)12)10-8-5-3-2-4-6-8;6-3(5(9)10)1-2-4(7)8/h2-7,10H,1H3,(H,11,12);1-2H2,(H,7,8)(H,9,10)