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

Systemtic Name: 3-(4-butoxyphenyl)-6-methyl-benzene-1,2-dicarbonitrile Openeye Name: 3-(4-butoxyphenyl)-6-methyl-phthalonitrile CAS Name: 3-(4-butoxyphenyl)-6-methylbenzene-1,2-dicarbonitrile IUPAC Name: 3-(4-butoxyphenyl)-6-methylbenzene-1,2-dicarbonitrile Traditional Name: 3-(4-butoxyphenyl)-6-methyl-phthalonitrile Formula: C19H18N2O MolecularWeight: 290.35902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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