1-[(4-methoxyphenyl)methyl]-1-azoniabicyclo[2.2.2]octan-3-one bromide

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-1-azoniabicyclo[2.2.2]octan-3-one bromide Openeye Name: 1-[(4-methoxyphenyl)methyl]quinuclidin-1-ium-3-one bromide CAS Name: 1-[(4-methoxyphenyl)methyl]-1-azoniabicyclo[2.2.2]octan-3-one bromide IUPAC Name: 1-[(4-methoxyphenyl)methyl]-1-azoniabicyclo[2.2.2]octan-3-one bromide Traditional Name: 1-p-anisylquinuclidin-1-ium-3-one bromide Formula: C15H20BrNO2 MolecularWeight: 326.2288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[N+]23CCC(CC2)C(=O)C3.[Br-]

Isomeric SMILES

COC1=CC=C(C=C1)C[N+]23CCC(CC2)C(=O)C3.[Br-]

InChI

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