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

Systemtic Name: 3-[1-(4-pentylcyclohexyl)cyclohexyl]-6-propyl-benzene-1,2-dicarbonitrile Openeye Name: 3-[1-(4-pentylcyclohexyl)cyclohexyl]-6-propyl-phthalonitrile CAS Name: 3-[1-(4-pentylcyclohexyl)cyclohexyl]-6-propylbenzene-1,2-dicarbonitrile IUPAC Name: 3-[1-(4-pentylcyclohexyl)cyclohexyl]-6-propylbenzene-1,2-dicarbonitrile Traditional Name: 3-[1-(4-amylcyclohexyl)cyclohexyl]-6-propyl-phthalonitrile Formula: C28H40N2 MolecularWeight: 404.6306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H40N2/c1-3-5-7-11-22-12-15-24(16-13-22)28(18-8-6-9-19-28)27-17-14-23(10-4-2)25(20-29)26(27)21-30/h14,17,22,24H,3-13,15-16,18-19H2,1-2H3