3-(4-pentoxyphenyl)benzene-1,2-dicarbonitrile

Systemtic Name: 3-(4-pentoxyphenyl)benzene-1,2-dicarbonitrile Openeye Name: 3-(4-pentoxyphenyl)phthalonitrile CAS Name: 3-(4-pentoxyphenyl)benzene-1,2-dicarbonitrile IUPAC Name: 3-(4-pentoxyphenyl)benzene-1,2-dicarbonitrile Traditional Name: 3-(4-amoxyphenyl)phthalonitrile Formula: C19H18N2O MolecularWeight: 290.35902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2=CC=CC(=C2C#N)C#N

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=CC=CC(=C2C#N)C#N

InChI

InChI=1S/C19H18N2O/c1-2-3-4-12-22-17-10-8-15(9-11-17)18-7-5-6-16(13-20)19(18)14-21/h5-11H,2-4,12H2,1H3