3-methyl-6-[1-(4-pentylcyclohexyl)cyclohexyl]benzene-1,2-dicarbonitrile

Systemtic Name: 3-methyl-6-[1-(4-pentylcyclohexyl)cyclohexyl]benzene-1,2-dicarbonitrile Openeye Name: 3-methyl-6-[1-(4-pentylcyclohexyl)cyclohexyl]phthalonitrile CAS Name: 3-methyl-6-[1-(4-pentylcyclohexyl)cyclohexyl]benzene-1,2-dicarbonitrile IUPAC Name: 3-methyl-6-[1-(4-pentylcyclohexyl)cyclohexyl]benzene-1,2-dicarbonitrile Traditional Name: 3-[1-(4-amylcyclohexyl)cyclohexyl]-6-methyl-phthalonitrile Formula: C26H36N2 MolecularWeight: 376.57744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2(CCCCC2)C3=C(C(=C(C=C3)C)C#N)C#N

Isomeric SMILES

CCCCCC1CCC(CC1)C2(CCCCC2)C3=C(C(=C(C=C3)C)C#N)C#N

InChI

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