3-(1-azabicyclo[2.2.2]octan-3-ylamino)-4-fluoranyl-benzoic acid

Systemtic Name: 3-(1-azabicyclo[2.2.2]octan-3-ylamino)-4-fluoranyl-benzoic acid Openeye Name: 4-fluoro-3-(quinuclidin-3-ylamino)benzoic acid CAS Name: 3-(1-azabicyclo[2.2.2]octan-3-ylamino)-4-fluorobenzoic acid IUPAC Name: 3-(1-azabicyclo[2.2.2]octan-3-ylamino)-4-fluorobenzoic acid Traditional Name: 4-fluoro-3-(quinuclidin-3-ylamino)benzoic acid Formula: C14H17FN2O2 MolecularWeight: 264.295383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC3=C(C=CC(=C3)C(=O)O)F

Isomeric SMILES

C1CN2CCC1C(C2)NC3=C(C=CC(=C3)C(=O)O)F

InChI

InChI=1S/C14H17FN2O2/c15-11-2-1-10(14(18)19)7-12(11)16-13-8-17-5-3-9(13)4-6-17/h1-2,7,9,13,16H,3-6,8H2,(H,18,19)