3-(4-methoxyphenyl)-6-pentyl-benzene-1,2-dicarbonitrile

Systemtic Name: 3-(4-methoxyphenyl)-6-pentyl-benzene-1,2-dicarbonitrile Openeye Name: 3-(4-methoxyphenyl)-6-pentyl-phthalonitrile CAS Name: 3-(4-methoxyphenyl)-6-pentylbenzene-1,2-dicarbonitrile IUPAC Name: 3-(4-methoxyphenyl)-6-pentylbenzene-1,2-dicarbonitrile Traditional Name: 3-amyl-6-(4-methoxyphenyl)phthalonitrile Formula: C20H20N2O MolecularWeight: 304.3856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(C=C1)C2=CC=C(C=C2)OC)C#N)C#N

Isomeric SMILES

CCCCCC1=C(C(=C(C=C1)C2=CC=C(C=C2)OC)C#N)C#N

InChI

InChI=1S/C20H20N2O/c1-3-4-5-6-15-9-12-18(20(14-22)19(15)13-21)16-7-10-17(23-2)11-8-16/h7-12H,3-6H2,1-2H3