ethyl 2-(1-methyl-1-azoniabicyclo[2.2.2]octan-4-yl)ethanoate bromide

Systemtic Name: ethyl 2-(1-methyl-1-azoniabicyclo[2.2.2]octan-4-yl)ethanoate bromide Openeye Name: ethyl 2-(1-methylquinuclidin-1-ium-4-yl)acetate bromide CAS Name: 2-(1-methyl-1-azoniabicyclo[2.2.2]octan-4-yl)acetic acid ethyl ester bromide IUPAC Name: ethyl 2-(1-methyl-1-azoniabicyclo[2.2.2]octan-4-yl)acetate bromide Traditional Name: 2-(1-methylquinuclidin-1-ium-4-yl)acetic acid ethyl ester bromide Formula: C12H22BrNO2 MolecularWeight: 292.21258

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC12CC[N+](CC1)(CC2)C.[Br-]

Isomeric SMILES

CCOC(=O)CC12CC[N+](CC1)(CC2)C.[Br-]

InChI

InChI=1S/C12H22NO2.BrH/c1-3-15-11(14)10-12-4-7-13(2,8-5-12)9-6-12;/h3-10H2,1-2H3;1H/q+1;/p-1