4-(2-ethynyl-3-oxidanyl-2-pyridin-3-yl-1-azabicyclo[2.2.2]octan-3-yl)-1-methoxy-butan-2-one

Systemtic Name: 4-(2-ethynyl-3-oxidanyl-2-pyridin-3-yl-1-azabicyclo[2.2.2]octan-3-yl)-1-methoxy-butan-2-one Openeye Name: 4-[2-ethynyl-3-hydroxy-2-(3-pyridyl)quinuclidin-3-yl]-1-methoxy-butan-2-one CAS Name: 4-[2-ethynyl-3-hydroxy-2-(3-pyridinyl)-1-azabicyclo[2.2.2]octan-3-yl]-1-methoxy-2-butanone IUPAC Name: 4-(2-ethynyl-3-hydroxy-2-pyridin-3-yl-1-azabicyclo[2.2.2]octan-3-yl)-1-methoxybutan-2-one Traditional Name: 4-[2-ethynyl-3-hydroxy-2-(3-pyridyl)quinuclidin-3-yl]-1-methoxy-butan-2-one Formula: C19H24N2O3 MolecularWeight: 328.40546

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)CCC1(C2CCN(C1(C#C)C3=CN=CC=C3)CC2)O

Isomeric SMILES

COCC(=O)CCC1(C2CCN(C1(C#C)C3=CN=CC=C3)CC2)O

InChI

InChI=1S/C19H24N2O3/c1-3-18(16-5-4-10-20-13-16)19(23,9-6-17(22)14-24-2)15-7-11-21(18)12-8-15/h1,4-5,10,13,15,23H,6-9,11-12,14H2,2H3