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

Systemtic Name: 3-(4-heptylcyclohexyl)-6-[4-(4-propylcyclohexyl)phenyl]benzene-1,2-dicarbonitrile Openeye Name: 3-(4-heptylcyclohexyl)-6-[4-(4-propylcyclohexyl)phenyl]phthalonitrile CAS Name: 3-(4-heptylcyclohexyl)-6-[4-(4-propylcyclohexyl)phenyl]benzene-1,2-dicarbonitrile IUPAC Name: 3-(4-heptylcyclohexyl)-6-[4-(4-propylcyclohexyl)phenyl]benzene-1,2-dicarbonitrile Traditional Name: 3-(4-heptylcyclohexyl)-6-[4-(4-propylcyclohexyl)phenyl]phthalonitrile Formula: C36H48N2 MolecularWeight: 508.77972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)C4CCC(CC4)CCC)C#N)C#N

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)C4CCC(CC4)CCC)C#N)C#N

InChI

InChI=1S/C36H48N2/c1-3-5-6-7-8-10-28-13-17-31(18-14-28)33-23-24-34(36(26-38)35(33)25-37)32-21-19-30(20-22-32)29-15-11-27(9-4-2)12-16-29/h19-24,27-29,31H,3-18H2,1-2H3