(3S)-3-(2-oxidanidyl-2-oxidanylidene-ethyl)-1-azoniabicyclo[2.2.2]octane-3-carboxylate

Systemtic Name: (3S)-3-(2-oxidanidyl-2-oxidanylidene-ethyl)-1-azoniabicyclo[2.2.2]octane-3-carboxylate Openeye Name: (3S)-3-(2-oxido-2-oxo-ethyl)quinuclidin-1-ium-3-carboxylate CAS Name: (3S)-3-(2-oxido-2-oxoethyl)-1-azoniabicyclo[2.2.2]octane-3-carboxylate IUPAC Name: (3S)-3-(2-oxido-2-oxoethyl)-1-azoniabicyclo[2.2.2]octane-3-carboxylate Traditional Name: (3S)-3-(2-keto-2-oxido-ethyl)quinuclidin-1-ium-3-carboxylate Formula: C10H14NO4- MolecularWeight: 212.22246

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(C2)(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1C[NH+]2CCC1[C@](C2)(CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C10H15NO4/c12-8(13)5-10(9(14)15)6-11-3-1-7(10)2-4-11/h7H,1-6H2,(H,12,13)(H,14,15)/p-1/t10-/m1/s1