6-(3-cyanophenyl)pyridine-3-carboxylic acid

Systemtic Name: 6-(3-cyanophenyl)pyridine-3-carboxylic acid Openeye Name: 6-(3-cyanophenyl)pyridine-3-carboxylic acid CAS Name: 6-(3-cyanophenyl)-3-pyridinecarboxylic acid IUPAC Name: 6-(3-cyanophenyl)pyridine-3-carboxylic acid Traditional Name: 6-(3-cyanophenyl)nicotinic acid Formula: C13H8N2O2 MolecularWeight: 224.21482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=NC=C(C=C2)C(=O)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C2=NC=C(C=C2)C(=O)O)C#N

InChI

InChI=1S/C13H8N2O2/c14-7-9-2-1-3-10(6-9)12-5-4-11(8-15-12)13(16)17/h1-6,8H,(H,16,17)