1-methyl-3-morpholin-4-yl-1-azoniabicyclo[2.2.2]octane-3-carbonitrile iodide

Systemtic Name: 1-methyl-3-morpholin-4-yl-1-azoniabicyclo[2.2.2]octane-3-carbonitrile iodide Openeye Name: 1-methyl-3-morpholino-quinuclidin-1-ium-3-carbonitrile iodide CAS Name: 1-methyl-3-(4-morpholinyl)-1-azoniabicyclo[2.2.2]octane-3-carbonitrile iodide IUPAC Name: 1-methyl-3-morpholin-4-yl-1-azoniabicyclo[2.2.2]octane-3-carbonitrile iodide Traditional Name: 1-methyl-3-morpholino-quinuclidin-1-ium-3-carbonitrile iodide Formula: C13H22IN3O MolecularWeight: 363.23775

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]12CCC(CC1)C(C2)(C#N)N3CCOCC3.[I-]

Isomeric SMILES

C[N+]12CCC(CC1)C(C2)(C#N)N3CCOCC3.[I-]

InChI

InChI=1S/C13H22N3O.HI/c1-16-6-2-12(3-7-16)13(10-14,11-16)15-4-8-17-9-5-15;/h12H,2-9,11H2,1H3;1H/q+1;/p-1