3-pentyl-6-[2-(1-propyl-4-bicyclo[2.2.2]octanyl)ethyl]benzene-1,2-dicarbonitrile

Systemtic Name: 3-pentyl-6-[2-(1-propyl-4-bicyclo[2.2.2]octanyl)ethyl]benzene-1,2-dicarbonitrile Openeye Name: 3-pentyl-6-[2-(1-propyl-4-bicyclo[2.2.2]octanyl)ethyl]phthalonitrile CAS Name: 3-pentyl-6-[2-(1-propyl-4-bicyclo[2.2.2]octanyl)ethyl]benzene-1,2-dicarbonitrile IUPAC Name: 3-pentyl-6-[2-(1-propyl-4-bicyclo[2.2.2]octanyl)ethyl]benzene-1,2-dicarbonitrile Traditional Name: 3-amyl-6-[2-(1-propyl-4-bicyclo[2.2.2]octanyl)ethyl]phthalonitrile Formula: C26H36N2 MolecularWeight: 376.57744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(C=C1)CCC23CCC(CC2)(CC3)CCC)C#N)C#N

Isomeric SMILES

CCCCCC1=C(C(=C(C=C1)CCC23CCC(CC2)(CC3)CCC)C#N)C#N

InChI

InChI=1S/C26H36N2/c1-3-5-6-7-21-8-9-22(24(20-28)23(21)19-27)10-12-26-16-13-25(11-4-2,14-17-26)15-18-26/h8-9H,3-7,10-18H2,1-2H3