3-butyl-6-[2-(4-pentylcyclohexyl)ethyl]benzene-1,2-dicarbonitrile

Systemtic Name: 3-butyl-6-[2-(4-pentylcyclohexyl)ethyl]benzene-1,2-dicarbonitrile Openeye Name: 3-butyl-6-[2-(4-pentylcyclohexyl)ethyl]phthalonitrile CAS Name: 3-butyl-6-[2-(4-pentylcyclohexyl)ethyl]benzene-1,2-dicarbonitrile IUPAC Name: 3-butyl-6-[2-(4-pentylcyclohexyl)ethyl]benzene-1,2-dicarbonitrile Traditional Name: 3-[2-(4-amylcyclohexyl)ethyl]-6-butyl-phthalonitrile Formula: C25H36N2 MolecularWeight: 364.56674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CCC2=C(C(=C(C=C2)CCCC)C#N)C#N

Isomeric SMILES

CCCCCC1CCC(CC1)CCC2=C(C(=C(C=C2)CCCC)C#N)C#N

InChI

InChI=1S/C25H36N2/c1-3-5-7-8-20-10-12-21(13-11-20)14-15-23-17-16-22(9-6-4-2)24(18-26)25(23)19-27/h16-17,20-21H,3-15H2,1-2H3