5-butyl-8-chloranyl-5-azabicyclo[2.2.2]oct-2-ene-8-carbonitrile

Systemtic Name: 5-butyl-8-chloranyl-5-azabicyclo[2.2.2]oct-2-ene-8-carbonitrile Openeye Name: 5-butyl-8-chloro-5-azabicyclo[2.2.2]oct-2-ene-8-carbonitrile CAS Name: 5-butyl-8-chloro-5-azabicyclo[2.2.2]oct-2-ene-8-carbonitrile IUPAC Name: 5-butyl-8-chloro-5-azabicyclo[2.2.2]oct-2-ene-8-carbonitrile Traditional Name: 5-butyl-8-chloro-5-azabicyclo[2.2.2]oct-2-ene-8-carbonitrile Formula: C12H17ClN2 MolecularWeight: 224.72978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC2CC(C1C=C2)(C#N)Cl

Isomeric SMILES

CCCCN1CC2CC(C1C=C2)(C#N)Cl

InChI

InChI=1S/C12H17ClN2/c1-2-3-6-15-8-10-4-5-11(15)12(13,7-10)9-14/h4-5,10-11H,2-3,6-8H2,1H3