3-(5-chloranylpyridin-3-yl)-8-oxidanyl-8-azabicyclo[3.2.1]oct-6-ene-3-carbonitrile

Systemtic Name: 3-(5-chloranylpyridin-3-yl)-8-oxidanyl-8-azabicyclo[3.2.1]oct-6-ene-3-carbonitrile Openeye Name: 3-(5-chloro-3-pyridyl)-8-hydroxy-8-azabicyclo[3.2.1]oct-6-ene-3-carbonitrile CAS Name: 3-(5-chloro-3-pyridinyl)-8-hydroxy-8-azabicyclo[3.2.1]oct-6-ene-3-carbonitrile IUPAC Name: 3-(5-chloropyridin-3-yl)-8-hydroxy-8-azabicyclo[3.2.1]oct-6-ene-3-carbonitrile Traditional Name: 3-(5-chloro-3-pyridyl)-8-hydroxy-8-azabicyclo[3.2.1]oct-6-ene-3-carbonitrile Formula: C13H12ClN3O MolecularWeight: 261.70688

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C=CC(N2O)CC1(C#N)C3=CC(=CN=C3)Cl

Isomeric SMILES

C1C2C=CC(N2O)CC1(C#N)C3=CC(=CN=C3)Cl

InChI

InChI=1S/C13H12ClN3O/c14-10-3-9(6-16-7-10)13(8-15)4-11-1-2-12(5-13)17(11)18/h1-3,6-7,11-12,18H,4-5H2