3-[(5-cyanopyridin-2-yl)amino]benzoic acid

Systemtic Name: 3-[(5-cyanopyridin-2-yl)amino]benzoic acid Openeye Name: 3-[(5-cyano-2-pyridyl)amino]benzoic acid CAS Name: 3-[(5-cyano-2-pyridinyl)amino]benzoic acid IUPAC Name: 3-[(5-cyanopyridin-2-yl)amino]benzoic acid Traditional Name: 3-[(5-cyano-2-pyridyl)amino]benzoic acid Formula: C13H9N3O2 MolecularWeight: 239.22946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC=C(C=C2)C#N)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC=C(C=C2)C#N)C(=O)O

InChI

InChI=1S/C13H9N3O2/c14-7-9-4-5-12(15-8-9)16-11-3-1-2-10(6-11)13(17)18/h1-6,8H,(H,15,16)(H,17,18)