1-azoniabicyclo[2.2.2]octan-3-yl(phenyl)methanone chloride

Systemtic Name: 1-azoniabicyclo[2.2.2]octan-3-yl(phenyl)methanone chloride Openeye Name: phenyl(quinuclidin-1-ium-3-yl)methanone chloride CAS Name: 1-azoniabicyclo[2.2.2]octan-3-yl(phenyl)methanone chloride IUPAC Name: 1-azoniabicyclo[2.2.2]octan-3-yl(phenyl)methanone chloride Traditional Name: phenyl(quinuclidin-1-ium-3-yl)methanone chloride Formula: C14H18ClNO MolecularWeight: 251.75182

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(C2)C(=O)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1C[NH+]2CCC1C(C2)C(=O)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C14H17NO.ClH/c16-14(12-4-2-1-3-5-12)13-10-15-8-6-11(13)7-9-15;/h1-5,11,13H,6-10H2;1H