3-butyl-6-(1-hexyl-4-bicyclo[2.2.2]octanyl)benzene-1,2-dicarbonitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC12CCC(CC1)(CC2)C3=C(C(=C(C=C3)CCCC)C#N)C#N

Isomeric SMILES

CCCCCCC12CCC(CC1)(CC2)C3=C(C(=C(C=C3)CCCC)C#N)C#N

InChI

InChI=1S/C26H36N2/c1-3-5-7-8-12-25-13-16-26(17-14-25,18-15-25)24-11-10-21(9-6-4-2)22(19-27)23(24)20-28/h10-11H,3-9,12-18H2,1-2H3