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

Systemtic Name: 3-(4-butoxyphenyl)-6-(4-methoxyphenyl)benzene-1,2-dicarbonitrile Openeye Name: 3-(4-butoxyphenyl)-6-(4-methoxyphenyl)phthalonitrile CAS Name: 3-(4-butoxyphenyl)-6-(4-methoxyphenyl)benzene-1,2-dicarbonitrile IUPAC Name: 3-(4-butoxyphenyl)-6-(4-methoxyphenyl)benzene-1,2-dicarbonitrile Traditional Name: 3-(4-butoxyphenyl)-6-(4-methoxyphenyl)phthalonitrile Formula: C25H22N2O2 MolecularWeight: 382.45438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)OC)C#N)C#N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)OC)C#N)C#N

InChI

InChI=1S/C25H22N2O2/c1-3-4-15-29-21-11-7-19(8-12-21)23-14-13-22(24(16-26)25(23)17-27)18-5-9-20(28-2)10-6-18/h5-14H,3-4,15H2,1-2H3