3-(5-chloranylpyridin-3-yl)-9-(2-methylpropyl)-9-azabicyclo[3.3.1]nonane-3-carbonitrile

Systemtic Name: 3-(5-chloranylpyridin-3-yl)-9-(2-methylpropyl)-9-azabicyclo[3.3.1]nonane-3-carbonitrile Openeye Name: 3-(5-chloro-3-pyridyl)-9-isobutyl-9-azabicyclo[3.3.1]nonane-3-carbonitrile CAS Name: 3-(5-chloro-3-pyridinyl)-9-(2-methylpropyl)-9-azabicyclo[3.3.1]nonane-3-carbonitrile IUPAC Name: 3-(5-chloropyridin-3-yl)-9-(2-methylpropyl)-9-azabicyclo[3.3.1]nonane-3-carbonitrile Traditional Name: 3-(5-chloro-3-pyridyl)-9-isobutyl-9-azabicyclo[3.3.1]nonane-3-carbonitrile Formula: C18H24ClN3 MolecularWeight: 317.85626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2CCCC1CC(C2)(C#N)C3=CC(=CN=C3)Cl

Isomeric SMILES

CC(C)CN1C2CCCC1CC(C2)(C#N)C3=CC(=CN=C3)Cl

InChI

InChI=1S/C18H24ClN3/c1-13(2)11-22-16-4-3-5-17(22)8-18(7-16,12-20)14-6-15(19)10-21-9-14/h6,9-10,13,16-17H,3-5,7-8,11H2,1-2H3