[(3S)-1-azoniabicyclo[2.2.2]octan-3-yl] 2-phenoxyethanoate

Systemtic Name: [(3S)-1-azoniabicyclo[2.2.2]octan-3-yl] 2-phenoxyethanoate Openeye Name: [(3S)-quinuclidin-1-ium-3-yl] 2-phenoxyacetate CAS Name: 2-phenoxyacetic acid [(3S)-1-azoniabicyclo[2.2.2]octan-3-yl] ester IUPAC Name: [(3S)-1-azoniabicyclo[2.2.2]octan-3-yl] 2-phenoxyacetate Traditional Name: 2-phenoxyacetic acid [(3S)-quinuclidin-1-ium-3-yl] ester Formula: C15H20NO3+ MolecularWeight: 262.3242

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(C2)OC(=O)COC3=CC=CC=C3

Isomeric SMILES

C1C[NH+]2CCC1[C@@H](C2)OC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C15H19NO3/c17-15(11-18-13-4-2-1-3-5-13)19-14-10-16-8-6-12(14)7-9-16/h1-5,12,14H,6-11H2/p+1/t14-/m1/s1