3-cyano-3-pyridin-2-yl-pentanedioic acid

Systemtic Name: 3-cyano-3-pyridin-2-yl-pentanedioic acid Openeye Name: 3-cyano-3-(2-pyridyl)pentanedioic acid CAS Name: 3-cyano-3-(2-pyridinyl)pentanedioic acid IUPAC Name: 3-cyano-3-pyridin-2-ylpentanedioic acid Traditional Name: 3-cyano-3-(2-pyridyl)glutaric acid Formula: C11H10N2O4 MolecularWeight: 234.2081

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10N2O4/c12-7-11(5-9(14)15,6-10(16)17)8-3-1-2-4-13-8/h1-4H,5-6H2,(H,14,15)(H,16,17)