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

Systemtic Name: 3-(4-ethoxyphenyl)-6-(4-heptylcyclohexyl)benzene-1,2-dicarbonitrile Openeye Name: 3-(4-ethoxyphenyl)-6-(4-heptylcyclohexyl)phthalonitrile CAS Name: 3-(4-ethoxyphenyl)-6-(4-heptylcyclohexyl)benzene-1,2-dicarbonitrile IUPAC Name: 3-(4-ethoxyphenyl)-6-(4-heptylcyclohexyl)benzene-1,2-dicarbonitrile Traditional Name: 3-(4-heptylcyclohexyl)-6-p-phenetyl-phthalonitrile Formula: C29H36N2O MolecularWeight: 428.60894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H36N2O/c1-3-5-6-7-8-9-22-10-12-23(13-11-22)26-18-19-27(29(21-31)28(26)20-30)24-14-16-25(17-15-24)32-4-2/h14-19,22-23H,3-13H2,1-2H3