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

Systemtic Name: (5-ethenyl-1-fluoranyl-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-yl-methanolate Openeye Name: (1-fluoro-5-vinyl-quinuclidin-1-ium-2-yl)-(4-quinolyl)methanolate CAS Name: (5-ethenyl-1-fluoro-1-azoniabicyclo[2.2.2]octan-2-yl)-(4-quinolinyl)methanolate IUPAC Name: (5-ethenyl-1-fluoro-1-azoniabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanolate Traditional Name: (1-fluoro-5-vinyl-quinuclidin-1-ium-2-yl)-(4-quinolyl)methanolate Formula: C19H21FN2O MolecularWeight: 312.381243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC1C[N+]2(CCC1CC2C(C3=CC=NC4=CC=CC=C34)[O-])F

Isomeric SMILES

C=CC1C[N+]2(CCC1CC2C(C3=CC=NC4=CC=CC=C34)[O-])F

InChI

InChI=1S/C19H21FN2O/c1-2-13-12-22(20)10-8-14(13)11-18(22)19(23)16-7-9-21-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19H,1,8,10-12H2