[(9S)-4-piperidin-1-ium-1-yl-9-bicyclo[3.3.1]nonanyl] ethanoate

Systemtic Name: [(9S)-4-piperidin-1-ium-1-yl-9-bicyclo[3.3.1]nonanyl] ethanoate Openeye Name: [(9S)-4-piperidin-1-ium-1-yl-9-bicyclo[3.3.1]nonanyl] acetate CAS Name: acetic acid [(9S)-4-(1-piperidin-1-iumyl)-9-bicyclo[3.3.1]nonanyl] ester IUPAC Name: [(9S)-4-piperidin-1-ium-1-yl-9-bicyclo[3.3.1]nonanyl] acetate Traditional Name: acetic acid [(9S)-4-piperidin-1-ium-1-yl-9-bicyclo[3.3.1]nonanyl] ester Formula: C16H28NO2+ MolecularWeight: 266.39902

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C2CCCC1C(CC2)[NH+]3CCCCC3

Isomeric SMILES

CC(=O)O[C@H]1C2CCCC1C(CC2)[NH+]3CCCCC3

InChI

InChI=1S/C16H27NO2/c1-12(18)19-16-13-6-5-7-14(16)15(9-8-13)17-10-3-2-4-11-17/h13-16H,2-11H2,1H3/p+1/t13?,14?,15?,16-/m0/s1