1-[(1R,2R)-2-bromanylcyclohexyl]-3,5-dimethyl-pyridin-1-ium bromide

Systemtic Name: 1-[(1R,2R)-2-bromanylcyclohexyl]-3,5-dimethyl-pyridin-1-ium bromide Openeye Name: 1-[(1R,2R)-2-bromocyclohexyl]-3,5-dimethyl-pyridin-1-ium bromide CAS Name: 1-[(1R,2R)-2-bromocyclohexyl]-3,5-dimethylpyridin-1-ium bromide IUPAC Name: 1-[(1R,2R)-2-bromocyclohexyl]-3,5-dimethylpyridin-1-ium bromide Traditional Name: 1-[(1R,2R)-2-bromocyclohexyl]-3,5-dimethyl-pyridin-1-ium bromide Formula: C13H19Br2N MolecularWeight: 349.10466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C[N+](=C1)C2CCCCC2Br)C.[Br-]

Isomeric SMILES

CC1=CC(=C[N+](=C1)[C@@H]2CCCC[C@H]2Br)C.[Br-]

InChI

InChI=1S/C13H19BrN.BrH/c1-10-7-11(2)9-15(8-10)13-6-4-3-5-12(13)14;/h7-9,12-13H,3-6H2,1-2H3;1H/q+1;/p-1/t12-,13-;/m1./s1