3-[6-[2-(3,5-dimethoxyphenyl)ethynyl]pyridazin-3-yl]oxy-1-azabicyclo[2.2.2]octane

Systemtic Name: 3-[6-[2-(3,5-dimethoxyphenyl)ethynyl]pyridazin-3-yl]oxy-1-azabicyclo[2.2.2]octane Openeye Name: 3-[6-[2-(3,5-dimethoxyphenyl)ethynyl]pyridazin-3-yl]oxyquinuclidine CAS Name: 3-[[6-[2-(3,5-dimethoxyphenyl)ethynyl]-3-pyridazinyl]oxy]-1-azabicyclo[2.2.2]octane IUPAC Name: 3-[6-[2-(3,5-dimethoxyphenyl)ethynyl]pyridazin-3-yl]oxy-1-azabicyclo[2.2.2]octane Traditional Name: 3-[6-[2-(3,5-dimethoxyphenyl)ethynyl]pyridazin-3-yl]oxyquinuclidine Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C#CC2=NN=C(C=C2)OC3CN4CCC3CC4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C#CC2=NN=C(C=C2)OC3CN4CCC3CC4)OC

InChI

InChI=1S/C21H23N3O3/c1-25-18-11-15(12-19(13-18)26-2)3-4-17-5-6-21(23-22-17)27-20-14-24-9-7-16(20)8-10-24/h5-6,11-13,16,20H,7-10,14H2,1-2H3