3-[2-(2-prop-2-enyl-4-pyrazin-2-yl-pyridin-3-yl)ethynyl]-1-azabicyclo[2.2.2]octan-3-ol

Systemtic Name: 3-[2-(2-prop-2-enyl-4-pyrazin-2-yl-pyridin-3-yl)ethynyl]-1-azabicyclo[2.2.2]octan-3-ol Openeye Name: 3-[2-(2-allyl-4-pyrazin-2-yl-3-pyridyl)ethynyl]quinuclidin-3-ol CAS Name: 3-[2-[2-prop-2-enyl-4-(2-pyrazinyl)-3-pyridinyl]ethynyl]-1-azabicyclo[2.2.2]octan-3-ol IUPAC Name: 3-[2-(2-prop-2-enyl-4-pyrazin-2-ylpyridin-3-yl)ethynyl]-1-azabicyclo[2.2.2]octan-3-ol Traditional Name: 3-[2-(2-allyl-4-pyrazin-2-yl-3-pyridyl)ethynyl]quinuclidin-3-ol Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=NC=CC(=C1C#CC2(CN3CCC2CC3)O)C4=NC=CN=C4

Isomeric SMILES

C=CCC1=NC=CC(=C1C#CC2(CN3CCC2CC3)O)C4=NC=CN=C4

InChI

InChI=1S/C21H22N4O/c1-2-3-19-17(18(5-9-23-19)20-14-22-10-11-24-20)4-8-21(26)15-25-12-6-16(21)7-13-25/h2,5,9-11,14,16,26H,1,3,6-7,12-13,15H2