3-(4-propoxycyclohexyl)-6-(4-propylphenyl)benzene-1,2-dicarbonitrile

Systemtic Name: 3-(4-propoxycyclohexyl)-6-(4-propylphenyl)benzene-1,2-dicarbonitrile Openeye Name: 3-(4-propoxycyclohexyl)-6-(4-propylphenyl)phthalonitrile CAS Name: 3-(4-propoxycyclohexyl)-6-(4-propylphenyl)benzene-1,2-dicarbonitrile IUPAC Name: 3-(4-propoxycyclohexyl)-6-(4-propylphenyl)benzene-1,2-dicarbonitrile Traditional Name: 3-(4-propoxycyclohexyl)-6-(4-propylphenyl)phthalonitrile Formula: C26H30N2O MolecularWeight: 386.5292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=C(C(=C(C=C2)C3CCC(CC3)OCCC)C#N)C#N

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=C(C(=C(C=C2)C3CCC(CC3)OCCC)C#N)C#N

InChI

InChI=1S/C26H30N2O/c1-3-5-19-6-8-20(9-7-19)23-14-15-24(26(18-28)25(23)17-27)21-10-12-22(13-11-21)29-16-4-2/h6-9,14-15,21-22H,3-5,10-13,16H2,1-2H3