[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl] 3-bromanylbenzoate

Systemtic Name: [(3R)-1-azoniabicyclo[2.2.2]octan-3-yl] 3-bromanylbenzoate Openeye Name: [(3R)-quinuclidin-1-ium-3-yl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [(3R)-1-azoniabicyclo[2.2.2]octan-3-yl] ester IUPAC Name: [(3R)-1-azoniabicyclo[2.2.2]octan-3-yl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [(3R)-quinuclidin-1-ium-3-yl] ester Formula: C14H17BrNO2+ MolecularWeight: 311.19428

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(C2)OC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1C[NH+]2CCC1[C@H](C2)OC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C14H16BrNO2/c15-12-3-1-2-11(8-12)14(17)18-13-9-16-6-4-10(13)5-7-16/h1-3,8,10,13H,4-7,9H2/p+1/t13-/m0/s1