1-methyl-2-(phenoxymethyl)-1-azoniabicyclo[2.2.2]octan-3-one iodide

Systemtic Name: 1-methyl-2-(phenoxymethyl)-1-azoniabicyclo[2.2.2]octan-3-one iodide Openeye Name: 1-methyl-2-(phenoxymethyl)quinuclidin-1-ium-3-one iodide CAS Name: 1-methyl-2-(phenoxymethyl)-1-azoniabicyclo[2.2.2]octan-3-one iodide IUPAC Name: 1-methyl-2-(phenoxymethyl)-1-azoniabicyclo[2.2.2]octan-3-one iodide Traditional Name: 1-methyl-2-(phenoxymethyl)quinuclidin-1-ium-3-one iodide Formula: C15H20INO2 MolecularWeight: 373.22927

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]12CCC(CC1)C(=O)C2COC3=CC=CC=C3.[I-]

Isomeric SMILES

C[N+]12CCC(CC1)C(=O)C2COC3=CC=CC=C3.[I-]

InChI

InChI=1S/C15H20NO2.HI/c1-16-9-7-12(8-10-16)15(17)14(16)11-18-13-5-3-2-4-6-13;/h2-6,12,14H,7-11H2,1H3;1H/q+1;/p-1