3-(5-chloranylpyridin-3-yl)-8-(phenylmethyl)-8-azabicyclo[3.2.1]octane-3-carbonitrile

Systemtic Name: 3-(5-chloranylpyridin-3-yl)-8-(phenylmethyl)-8-azabicyclo[3.2.1]octane-3-carbonitrile Openeye Name: 8-benzyl-3-(5-chloro-3-pyridyl)-8-azabicyclo[3.2.1]octane-3-carbonitrile CAS Name: 3-(5-chloro-3-pyridinyl)-8-(phenylmethyl)-8-azabicyclo[3.2.1]octane-3-carbonitrile IUPAC Name: 8-benzyl-3-(5-chloropyridin-3-yl)-8-azabicyclo[3.2.1]octane-3-carbonitrile Traditional Name: 8-benzyl-3-(5-chloro-3-pyridyl)-8-azabicyclo[3.2.1]octane-3-carbonitrile Formula: C20H20ClN3 MolecularWeight: 337.8459

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC1N2CC3=CC=CC=C3)(C#N)C4=CC(=CN=C4)Cl

Isomeric SMILES

C1CC2CC(CC1N2CC3=CC=CC=C3)(C#N)C4=CC(=CN=C4)Cl

InChI

InChI=1S/C20H20ClN3/c21-17-8-16(11-23-12-17)20(14-22)9-18-6-7-19(10-20)24(18)13-15-4-2-1-3-5-15/h1-5,8,11-12,18-19H,6-7,9-10,13H2