3-(2,6-dimethylphenoxy)-1-azoniabicyclo[2.2.2]octane chloride

Systemtic Name: 3-(2,6-dimethylphenoxy)-1-azoniabicyclo[2.2.2]octane chloride Openeye Name: 3-(2,6-dimethylphenoxy)quinuclidin-1-ium chloride CAS Name: 3-(2,6-dimethylphenoxy)-1-azoniabicyclo[2.2.2]octane chloride IUPAC Name: 3-(2,6-dimethylphenoxy)-1-azoniabicyclo[2.2.2]octane chloride Traditional Name: 3-(2,6-dimethylphenoxy)quinuclidin-1-ium chloride Formula: C15H22ClNO MolecularWeight: 267.79428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC2C[NH+]3CCC2CC3.[Cl-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC2C[NH+]3CCC2CC3.[Cl-]

InChI

InChI=1S/C15H21NO.ClH/c1-11-4-3-5-12(2)15(11)17-14-10-16-8-6-13(14)7-9-16;/h3-5,13-14H,6-10H2,1-2H3;1H