2-(3-fluorophenyl)-5-[2-(6-methylpyridin-2-yl)ethynyl]benzenecarbonitrile hydrobromide

Systemtic Name: 2-(3-fluorophenyl)-5-[2-(6-methylpyridin-2-yl)ethynyl]benzenecarbonitrile hydrobromide Openeye Name: 2-(3-fluorophenyl)-5-[2-(6-methyl-2-pyridyl)ethynyl]benzonitrile hydrobromide CAS Name: 2-(3-fluorophenyl)-5-[2-(6-methyl-2-pyridinyl)ethynyl]benzonitrile hydrobromide IUPAC Name: 2-(3-fluorophenyl)-5-[2-(6-methylpyridin-2-yl)ethynyl]benzonitrile hydrobromide Traditional Name: 2-(3-fluorophenyl)-5-[2-(6-methyl-2-pyridyl)ethynyl]benzonitrile hydrobromide Formula: C21H14BrFN2 MolecularWeight: 393.251663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=N1)C#CC2=CC(=C(C=C2)C3=CC(=CC=C3)F)C#N.Br

Isomeric SMILES

CC1=CC=CC(=N1)C#CC2=CC(=C(C=C2)C3=CC(=CC=C3)F)C#N.Br

InChI

InChI=1S/C21H13FN2.BrH/c1-15-4-2-7-20(24-15)10-8-16-9-11-21(18(12-16)14-23)17-5-3-6-19(22)13-17;/h2-7,9,11-13H,1H3;1H