3-[2-chloranyl-4-(2-phenylethynyl)phenyl]-2-pyridin-3-yl-pentanenitrile

Systemtic Name: 3-[2-chloranyl-4-(2-phenylethynyl)phenyl]-2-pyridin-3-yl-pentanenitrile Openeye Name: 3-[2-chloro-4-(2-phenylethynyl)phenyl]-2-(3-pyridyl)pentanenitrile CAS Name: 3-[2-chloro-4-(2-phenylethynyl)phenyl]-2-(3-pyridinyl)pentanenitrile IUPAC Name: 3-[2-chloro-4-(2-phenylethynyl)phenyl]-2-pyridin-3-ylpentanenitrile Traditional Name: 3-[2-chloro-4-(2-phenylethynyl)phenyl]-2-(3-pyridyl)valeronitrile Formula: C24H19ClN2 MolecularWeight: 370.87406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=C(C=C1)C#CC2=CC=CC=C2)Cl)C(C#N)C3=CN=CC=C3

Isomeric SMILES

CCC(C1=C(C=C(C=C1)C#CC2=CC=CC=C2)Cl)C(C#N)C3=CN=CC=C3

InChI

InChI=1S/C24H19ClN2/c1-2-21(23(16-26)20-9-6-14-27-17-20)22-13-12-19(15-24(22)25)11-10-18-7-4-3-5-8-18/h3-9,12-15,17,21,23H,2H2,1H3