3-(4-heptylcyclohexyl)-6-(4-heptylphenyl)benzene-1,2-dicarbonitrile

Systemtic Name: 3-(4-heptylcyclohexyl)-6-(4-heptylphenyl)benzene-1,2-dicarbonitrile Openeye Name: 3-(4-heptylcyclohexyl)-6-(4-heptylphenyl)phthalonitrile CAS Name: 3-(4-heptylcyclohexyl)-6-(4-heptylphenyl)benzene-1,2-dicarbonitrile IUPAC Name: 3-(4-heptylcyclohexyl)-6-(4-heptylphenyl)benzene-1,2-dicarbonitrile Traditional Name: 3-(4-heptylcyclohexyl)-6-(4-heptylphenyl)phthalonitrile Formula: C34H46N2 MolecularWeight: 482.74244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)CCCCCCC)C#N)C#N

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)CCCCCCC)C#N)C#N

InChI

InChI=1S/C34H46N2/c1-3-5-7-9-11-13-27-15-19-29(20-16-27)31-23-24-32(34(26-36)33(31)25-35)30-21-17-28(18-22-30)14-12-10-8-6-4-2/h15-16,19-20,23-24,28,30H,3-14,17-18,21-22H2,1-2H3