(8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-fluoranyl-2,2-diphenyl-ethanoate

Systemtic Name: (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-fluoranyl-2,2-diphenyl-ethanoate Openeye Name: (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-fluoro-2,2-diphenyl-acetate CAS Name: 2-fluoro-2,2-diphenylacetic acid (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) ester IUPAC Name: (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-fluoro-2,2-diphenylacetate Traditional Name: 2-fluoro-2,2-diphenyl-acetic acid (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) ester Formula: C23H27FNO2+ MolecularWeight: 368.464383

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)F)C

Isomeric SMILES

C[N+]1(C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)F)C

InChI

InChI=1S/C23H27FNO2/c1-25(2)19-13-14-20(25)16-21(15-19)27-22(26)23(24,17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,19-21H,13-16H2,1-2H3/q+1