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

Systemtic Name: 3-(4-ethoxyphenyl)-6-(4-propylphenyl)benzene-1,2-dicarbonitrile Openeye Name: 3-(4-ethoxyphenyl)-6-(4-propylphenyl)phthalonitrile CAS Name: 3-(4-ethoxyphenyl)-6-(4-propylphenyl)benzene-1,2-dicarbonitrile IUPAC Name: 3-(4-ethoxyphenyl)-6-(4-propylphenyl)benzene-1,2-dicarbonitrile Traditional Name: 3-p-phenetyl-6-(4-propylphenyl)phthalonitrile Formula: C25H22N2O MolecularWeight: 366.45498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)OCC)C#N)C#N

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)OCC)C#N)C#N

InChI

InChI=1S/C25H22N2O/c1-3-5-18-6-8-19(9-7-18)22-14-15-23(25(17-27)24(22)16-26)20-10-12-21(13-11-20)28-4-2/h6-15H,3-5H2,1-2H3