1-ethyl-1-azoniabicyclo[2.2.2]octane-4-carboxylic acid

Systemtic Name: 1-ethyl-1-azoniabicyclo[2.2.2]octane-4-carboxylic acid Openeye Name: 1-ethylquinuclidin-1-ium-4-carboxylic acid CAS Name: 1-ethyl-1-azoniabicyclo[2.2.2]octane-4-carboxylic acid IUPAC Name: 1-ethyl-1-azoniabicyclo[2.2.2]octane-4-carboxylic acid Traditional Name: 1-ethylquinuclidin-1-ium-4-carboxylic acid Formula: C10H18NO2+ MolecularWeight: 184.25542

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]12CCC(CC1)(CC2)C(=O)O

Isomeric SMILES

CC[N+]12CCC(CC1)(CC2)C(=O)O

InChI

InChI=1S/C10H17NO2/c1-2-11-6-3-10(4-7-11,5-8-11)9(12)13/h2-8H2,1H3/p+1