3-[4-(4-heptylcyclohexyl)phenyl]-6-(4-methoxyphenyl)benzene-1,2-dicarbonitrile

Systemtic Name: 3-[4-(4-heptylcyclohexyl)phenyl]-6-(4-methoxyphenyl)benzene-1,2-dicarbonitrile Openeye Name: 3-[4-(4-heptylcyclohexyl)phenyl]-6-(4-methoxyphenyl)phthalonitrile CAS Name: 3-[4-(4-heptylcyclohexyl)phenyl]-6-(4-methoxyphenyl)benzene-1,2-dicarbonitrile IUPAC Name: 3-[4-(4-heptylcyclohexyl)phenyl]-6-(4-methoxyphenyl)benzene-1,2-dicarbonitrile Traditional Name: 3-[4-(4-heptylcyclohexyl)phenyl]-6-(4-methoxyphenyl)phthalonitrile Formula: C34H38N2O MolecularWeight: 490.67832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=C(C(=C(C=C3)C4=CC=C(C=C4)OC)C#N)C#N

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=C(C(=C(C=C3)C4=CC=C(C=C4)OC)C#N)C#N

InChI

InChI=1S/C34H38N2O/c1-3-4-5-6-7-8-25-9-11-26(12-10-25)27-13-15-28(16-14-27)31-21-22-32(34(24-36)33(31)23-35)29-17-19-30(37-2)20-18-29/h13-22,25-26H,3-12H2,1-2H3