3-(4-hexoxyphenyl)-6-[4-(4-propylcyclohexyl)phenyl]benzene-1,2-dicarbonitrile

Systemtic Name: 3-(4-hexoxyphenyl)-6-[4-(4-propylcyclohexyl)phenyl]benzene-1,2-dicarbonitrile Openeye Name: 3-(4-hexoxyphenyl)-6-[4-(4-propylcyclohexyl)phenyl]phthalonitrile CAS Name: 3-(4-hexoxyphenyl)-6-[4-(4-propylcyclohexyl)phenyl]benzene-1,2-dicarbonitrile IUPAC Name: 3-(4-hexoxyphenyl)-6-[4-(4-propylcyclohexyl)phenyl]benzene-1,2-dicarbonitrile Traditional Name: 3-(4-hexoxyphenyl)-6-[4-(4-propylcyclohexyl)phenyl]phthalonitrile Formula: C35H40N2O MolecularWeight: 504.7049

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)C4CCC(CC4)CCC)C#N)C#N

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)C4CCC(CC4)CCC)C#N)C#N

InChI

InChI=1S/C35H40N2O/c1-3-5-6-7-23-38-31-19-17-30(18-20-31)33-22-21-32(34(24-36)35(33)25-37)29-15-13-28(14-16-29)27-11-9-26(8-4-2)10-12-27/h13-22,26-27H,3-12,23H2,1-2H3