2-(3-cyanophenyl)carbonylpyridine-3-carboxylic acid

Systemtic Name: 2-(3-cyanophenyl)carbonylpyridine-3-carboxylic acid Openeye Name: 2-(3-cyanobenzoyl)pyridine-3-carboxylic acid CAS Name: 2-[(3-cyanophenyl)-oxomethyl]-3-pyridinecarboxylic acid IUPAC Name: 2-(3-cyanobenzoyl)pyridine-3-carboxylic acid Traditional Name: 2-(3-cyanobenzoyl)nicotinic acid Formula: C14H8N2O3 MolecularWeight: 252.22492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)C2=C(C=CC=N2)C(=O)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)C2=C(C=CC=N2)C(=O)O)C#N

InChI

InChI=1S/C14H8N2O3/c15-8-9-3-1-4-10(7-9)13(17)12-11(14(18)19)5-2-6-16-12/h1-7H,(H,18,19)