3-[2-(6-methylpyridin-2-yl)ethynyl]benzoic acid

Systemtic Name: 3-[2-(6-methylpyridin-2-yl)ethynyl]benzoic acid Openeye Name: 3-[2-(6-methyl-2-pyridyl)ethynyl]benzoic acid CAS Name: 3-[2-(6-methyl-2-pyridinyl)ethynyl]benzoic acid IUPAC Name: 3-[2-(6-methylpyridin-2-yl)ethynyl]benzoic acid Traditional Name: 3-[2-(6-methyl-2-pyridyl)ethynyl]benzoic acid Formula: C15H11NO2 MolecularWeight: 237.25334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=N1)C#CC2=CC(=CC=C2)C(=O)O

Isomeric SMILES

CC1=CC=CC(=N1)C#CC2=CC(=CC=C2)C(=O)O

InChI

InChI=1S/C15H11NO2/c1-11-4-2-7-14(16-11)9-8-12-5-3-6-13(10-12)15(17)18/h2-7,10H,1H3,(H,17,18)