3-pentyl-6-[3-(4-pentylcyclohexyl)propoxy]benzene-1,2-dicarbonitrile

Systemtic Name: 3-pentyl-6-[3-(4-pentylcyclohexyl)propoxy]benzene-1,2-dicarbonitrile Openeye Name: 3-pentyl-6-[3-(4-pentylcyclohexyl)propoxy]phthalonitrile CAS Name: 3-pentyl-6-[3-(4-pentylcyclohexyl)propoxy]benzene-1,2-dicarbonitrile IUPAC Name: 3-pentyl-6-[3-(4-pentylcyclohexyl)propoxy]benzene-1,2-dicarbonitrile Traditional Name: 3-amyl-6-[3-(4-amylcyclohexyl)propoxy]phthalonitrile Formula: C27H40N2O MolecularWeight: 408.6193

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CCCOC2=C(C(=C(C=C2)CCCCC)C#N)C#N

Isomeric SMILES

CCCCCC1CCC(CC1)CCCOC2=C(C(=C(C=C2)CCCCC)C#N)C#N

InChI

InChI=1S/C27H40N2O/c1-3-5-7-10-22-13-15-23(16-14-22)11-9-19-30-27-18-17-24(12-8-6-4-2)25(20-28)26(27)21-29/h17-18,22-23H,3-16,19H2,1-2H3