2-chloranyl-4-[2-(4-heptylcyclohexyl)ethynyl]benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-[2-(4-heptylcyclohexyl)ethynyl]benzenecarbonitrile Openeye Name: 2-chloro-4-[2-(4-heptylcyclohexyl)ethynyl]benzonitrile CAS Name: 2-chloro-4-[2-(4-heptylcyclohexyl)ethynyl]benzonitrile IUPAC Name: 2-chloro-4-[2-(4-heptylcyclohexyl)ethynyl]benzonitrile Traditional Name: 2-chloro-4-[2-(4-heptylcyclohexyl)ethynyl]benzonitrile Formula: C22H28ClN MolecularWeight: 341.91742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C#CC2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

CCCCCCCC1CCC(CC1)C#CC2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C22H28ClN/c1-2-3-4-5-6-7-18-8-10-19(11-9-18)12-13-20-14-15-21(17-24)22(23)16-20/h14-16,18-19H,2-11H2,1H3