(5-ethenyl-1-fluoranyl-1-azoniabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanolate

Systemtic Name: (5-ethenyl-1-fluoranyl-1-azoniabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanolate Openeye Name: (1-fluoro-5-vinyl-quinuclidin-1-ium-2-yl)-(6-methoxy-4-quinolyl)methanolate CAS Name: (5-ethenyl-1-fluoro-1-azoniabicyclo[2.2.2]octan-2-yl)-(6-methoxy-4-quinolinyl)methanolate IUPAC Name: (5-ethenyl-1-fluoro-1-azoniabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanolate Traditional Name: (1-fluoro-5-vinyl-quinuclidin-1-ium-2-yl)-(6-methoxy-4-quinolyl)methanolate Formula: C20H23FN2O2 MolecularWeight: 342.407223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CC[N+]3(CC4C=C)F)[O-]

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CC[N+]3(CC4C=C)F)[O-]

InChI

InChI=1S/C20H23FN2O2/c1-3-13-12-23(21)9-7-14(13)10-19(23)20(24)16-6-8-22-18-5-4-15(25-2)11-17(16)18/h3-6,8,11,13-14,19-20H,1,7,9-10,12H2,2H3