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

Systemtic Name: 3-pentyl-6-[3-(4-propylcyclohexyl)propoxy]benzene-1,2-dicarbonitrile Openeye Name: 3-pentyl-6-[3-(4-propylcyclohexyl)propoxy]phthalonitrile CAS Name: 3-pentyl-6-[3-(4-propylcyclohexyl)propoxy]benzene-1,2-dicarbonitrile IUPAC Name: 3-pentyl-6-[3-(4-propylcyclohexyl)propoxy]benzene-1,2-dicarbonitrile Traditional Name: 3-amyl-6-[3-(4-propylcyclohexyl)propoxy]phthalonitrile Formula: C25H36N2O MolecularWeight: 380.56614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(C=C1)OCCCC2CCC(CC2)CCC)C#N)C#N

Isomeric SMILES

CCCCCC1=C(C(=C(C=C1)OCCCC2CCC(CC2)CCC)C#N)C#N

InChI

InChI=1S/C25H36N2O/c1-3-5-6-10-22-15-16-25(24(19-27)23(22)18-26)28-17-7-9-21-13-11-20(8-4-2)12-14-21/h15-16,20-21H,3-14,17H2,1-2H3