2-ethynyl-6-methyl-3-pyridin-3-yl-2-(pyridin-4-ylmethyl)-1-azabicyclo[2.2.2]octan-3-ol

Systemtic Name: 2-ethynyl-6-methyl-3-pyridin-3-yl-2-(pyridin-4-ylmethyl)-1-azabicyclo[2.2.2]octan-3-ol Openeye Name: 2-ethynyl-6-methyl-3-(3-pyridyl)-2-(4-pyridylmethyl)quinuclidin-3-ol CAS Name: 2-ethynyl-6-methyl-3-(3-pyridinyl)-2-(pyridin-4-ylmethyl)-1-azabicyclo[2.2.2]octan-3-ol IUPAC Name: 2-ethynyl-6-methyl-3-pyridin-3-yl-2-(pyridin-4-ylmethyl)-1-azabicyclo[2.2.2]octan-3-ol Traditional Name: 2-ethynyl-6-methyl-3-(3-pyridyl)-2-(4-pyridylmethyl)quinuclidin-3-ol Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2CCN1C(C2(C3=CN=CC=C3)O)(CC4=CC=NC=C4)C#C

Isomeric SMILES

CC1CC2CCN1C(C2(C3=CN=CC=C3)O)(CC4=CC=NC=C4)C#C

InChI

InChI=1S/C21H23N3O/c1-3-20(14-17-6-10-22-11-7-17)21(25,19-5-4-9-23-15-19)18-8-12-24(20)16(2)13-18/h1,4-7,9-11,15-16,18,25H,8,12-14H2,2H3