1-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)butan-2-one bromide

Systemtic Name: 1-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)butan-2-one bromide Openeye Name: 1-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)butan-2-one bromide CAS Name: 1-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-2-butanone bromide IUPAC Name: 1-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)butan-2-one bromide Traditional Name: 1-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)butan-2-one bromide Formula: C10H19BrN2O MolecularWeight: 263.17466

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C[N+]12CCN(CC1)CC2.[Br-]

Isomeric SMILES

CCC(=O)C[N+]12CCN(CC1)CC2.[Br-]

InChI

InChI=1S/C10H19N2O.BrH/c1-2-10(13)9-12-6-3-11(4-7-12)5-8-12;/h2-9H2,1H3;1H/q+1;/p-1