5-(1-azabicyclo[2.2.2]octan-3-ylamino)-2-fluoranyl-benzoic acid

Systemtic Name: 5-(1-azabicyclo[2.2.2]octan-3-ylamino)-2-fluoranyl-benzoic acid Openeye Name: 2-fluoro-5-(quinuclidin-3-ylamino)benzoic acid CAS Name: 5-(1-azabicyclo[2.2.2]octan-3-ylamino)-2-fluorobenzoic acid IUPAC Name: 5-(1-azabicyclo[2.2.2]octan-3-ylamino)-2-fluorobenzoic acid Traditional Name: 2-fluoro-5-(quinuclidin-3-ylamino)benzoic acid Formula: C14H17FN2O2 MolecularWeight: 264.295383

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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