3-[2-(3-fluoranyl-5-pyridin-3-yloxy-phenyl)ethynyl]benzenecarbonitrile

Systemtic Name: 3-[2-(3-fluoranyl-5-pyridin-3-yloxy-phenyl)ethynyl]benzenecarbonitrile Openeye Name: 3-[2-[3-fluoro-5-(3-pyridyloxy)phenyl]ethynyl]benzonitrile CAS Name: 3-[2-[3-fluoro-5-(3-pyridinyloxy)phenyl]ethynyl]benzonitrile IUPAC Name: 3-[2-(3-fluoro-5-pyridin-3-yloxyphenyl)ethynyl]benzonitrile Traditional Name: 3-[2-[3-fluoro-5-(3-pyridyloxy)phenyl]ethynyl]benzonitrile Formula: C20H11FN2O MolecularWeight: 314.312543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C#N)C#CC2=CC(=CC(=C2)F)OC3=CN=CC=C3

Isomeric SMILES

C1=CC(=CC(=C1)C#N)C#CC2=CC(=CC(=C2)F)OC3=CN=CC=C3

InChI

InChI=1S/C20H11FN2O/c21-18-10-16(7-6-15-3-1-4-17(9-15)13-22)11-20(12-18)24-19-5-2-8-23-14-19/h1-5,8-12,14H