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

Systemtic Name: 3-[3-(4-heptylcyclohexyl)propoxy]-6-pentyl-benzene-1,2-dicarbonitrile Openeye Name: 3-[3-(4-heptylcyclohexyl)propoxy]-6-pentyl-phthalonitrile CAS Name: 3-[3-(4-heptylcyclohexyl)propoxy]-6-pentylbenzene-1,2-dicarbonitrile IUPAC Name: 3-[3-(4-heptylcyclohexyl)propoxy]-6-pentylbenzene-1,2-dicarbonitrile Traditional Name: 3-amyl-6-[3-(4-heptylcyclohexyl)propoxy]phthalonitrile Formula: C29H44N2O MolecularWeight: 436.67246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)CCCOC2=C(C(=C(C=C2)CCCCC)C#N)C#N

Isomeric SMILES

CCCCCCCC1CCC(CC1)CCCOC2=C(C(=C(C=C2)CCCCC)C#N)C#N

InChI

InChI=1S/C29H44N2O/c1-3-5-7-8-10-12-24-15-17-25(18-16-24)13-11-21-32-29-20-19-26(14-9-6-4-2)27(22-30)28(29)23-31/h19-20,24-25H,3-18,21H2,1-2H3