3-butoxy-6-(1-propyl-4-bicyclo[2.2.2]octanyl)benzene-1,2-dicarbonitrile

Systemtic Name: 3-butoxy-6-(1-propyl-4-bicyclo[2.2.2]octanyl)benzene-1,2-dicarbonitrile Openeye Name: 3-butoxy-6-(1-propyl-4-bicyclo[2.2.2]octanyl)phthalonitrile CAS Name: 3-butoxy-6-(1-propyl-4-bicyclo[2.2.2]octanyl)benzene-1,2-dicarbonitrile IUPAC Name: 3-butoxy-6-(1-propyl-4-bicyclo[2.2.2]octanyl)benzene-1,2-dicarbonitrile Traditional Name: 3-butoxy-6-(1-propyl-4-bicyclo[2.2.2]octanyl)phthalonitrile Formula: C23H30N2O MolecularWeight: 350.4971

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=C(C=C1)C23CCC(CC2)(CC3)CCC)C#N)C#N

Isomeric SMILES

CCCCOC1=C(C(=C(C=C1)C23CCC(CC2)(CC3)CCC)C#N)C#N

InChI

InChI=1S/C23H30N2O/c1-3-5-15-26-21-7-6-20(18(16-24)19(21)17-25)23-12-9-22(8-4-2,10-13-23)11-14-23/h6-7H,3-5,8-15H2,1-2H3