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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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