4-[2-(6-azanylpyridin-2-yl)ethynyl]benzoic acid

Systemtic Name: 4-[2-(6-azanylpyridin-2-yl)ethynyl]benzoic acid Openeye Name: 4-[2-(6-amino-2-pyridyl)ethynyl]benzoic acid CAS Name: 4-[2-(6-amino-2-pyridinyl)ethynyl]benzoic acid IUPAC Name: 4-[2-(6-aminopyridin-2-yl)ethynyl]benzoic acid Traditional Name: 4-[2-(6-amino-2-pyridyl)ethynyl]benzoic acid Formula: C14H10N2O2 MolecularWeight: 238.2414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC(=C1)N)C#CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CC(=NC(=C1)N)C#CC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H10N2O2/c15-13-3-1-2-12(16-13)9-6-10-4-7-11(8-5-10)14(17)18/h1-5,7-8H,(H2,15,16)(H,17,18)