3-[4-(4-pentylcyclohexyl)phenyl]-6-(4-propoxyphenyl)benzene-1,2-dicarbonitrile

Systemtic Name: 3-[4-(4-pentylcyclohexyl)phenyl]-6-(4-propoxyphenyl)benzene-1,2-dicarbonitrile Openeye Name: 3-[4-(4-pentylcyclohexyl)phenyl]-6-(4-propoxyphenyl)phthalonitrile CAS Name: 3-[4-(4-pentylcyclohexyl)phenyl]-6-(4-propoxyphenyl)benzene-1,2-dicarbonitrile IUPAC Name: 3-[4-(4-pentylcyclohexyl)phenyl]-6-(4-propoxyphenyl)benzene-1,2-dicarbonitrile Traditional Name: 3-[4-(4-amylcyclohexyl)phenyl]-6-(4-propoxyphenyl)phthalonitrile Formula: C34H38N2O MolecularWeight: 490.67832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=C(C(=C(C=C3)C4=CC=C(C=C4)OCCC)C#N)C#N

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=C(C(=C(C=C3)C4=CC=C(C=C4)OCCC)C#N)C#N

InChI

InChI=1S/C34H38N2O/c1-3-5-6-7-25-8-10-26(11-9-25)27-12-14-28(15-13-27)31-20-21-32(34(24-36)33(31)23-35)29-16-18-30(19-17-29)37-22-4-2/h12-21,25-26H,3-11,22H2,1-2H3