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

Systemtic Name: 3-ethoxy-6-(1-propyl-4-bicyclo[2.2.2]octanyl)benzene-1,2-dicarbonitrile Openeye Name: 3-ethoxy-6-(1-propyl-4-bicyclo[2.2.2]octanyl)phthalonitrile CAS Name: 3-ethoxy-6-(1-propyl-4-bicyclo[2.2.2]octanyl)benzene-1,2-dicarbonitrile IUPAC Name: 3-ethoxy-6-(1-propyl-4-bicyclo[2.2.2]octanyl)benzene-1,2-dicarbonitrile Traditional Name: 3-ethoxy-6-(1-propyl-4-bicyclo[2.2.2]octanyl)phthalonitrile Formula: C21H26N2O MolecularWeight: 322.44394

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Descriptors Computed from Structure

Canonical SMILES:

CCCC12CCC(CC1)(CC2)C3=C(C(=C(C=C3)OCC)C#N)C#N

Isomeric SMILES

CCCC12CCC(CC1)(CC2)C3=C(C(=C(C=C3)OCC)C#N)C#N

InChI

InChI=1S/C21H26N2O/c1-3-7-20-8-11-21(12-9-20,13-10-20)18-5-6-19(24-4-2)17(15-23)16(18)14-22/h5-6H,3-4,7-13H2,1-2H3