3-(5-chloranylpyridin-3-yl)-6-oxidanyl-8-(phenylmethyl)-8-azabicyclo[3.2.1]octane-3-carbonitrile

Systemtic Name: 3-(5-chloranylpyridin-3-yl)-6-oxidanyl-8-(phenylmethyl)-8-azabicyclo[3.2.1]octane-3-carbonitrile Openeye Name: 8-benzyl-3-(5-chloro-3-pyridyl)-6-hydroxy-8-azabicyclo[3.2.1]octane-3-carbonitrile CAS Name: 3-(5-chloro-3-pyridinyl)-6-hydroxy-8-(phenylmethyl)-8-azabicyclo[3.2.1]octane-3-carbonitrile IUPAC Name: 8-benzyl-3-(5-chloropyridin-3-yl)-6-hydroxy-8-azabicyclo[3.2.1]octane-3-carbonitrile Traditional Name: 8-benzyl-3-(5-chloro-3-pyridyl)-6-hydroxy-8-azabicyclo[3.2.1]octane-3-carbonitrile Formula: C20H20ClN3O MolecularWeight: 353.8453

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC(CC(C1O)N2CC3=CC=CC=C3)(C#N)C4=CC(=CN=C4)Cl

Isomeric SMILES

C1C2CC(CC(C1O)N2CC3=CC=CC=C3)(C#N)C4=CC(=CN=C4)Cl

InChI

InChI=1S/C20H20ClN3O/c21-16-6-15(10-23-11-16)20(13-22)8-17-7-19(25)18(9-20)24(17)12-14-4-2-1-3-5-14/h1-6,10-11,17-19,25H,7-9,12H2