2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-1-piperidin-1-yl-ethanone bromide

Systemtic Name: 2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-1-piperidin-1-yl-ethanone bromide Openeye Name: 2-(4,5-dimethylthiazol-3-ium-3-yl)-1-(1-piperidyl)ethanone bromide CAS Name: 2-(4,5-dimethyl-3-thiazol-3-iumyl)-1-(1-piperidinyl)ethanone bromide IUPAC Name: 2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-1-piperidin-1-ylethanone bromide Traditional Name: 2-(4,5-dimethylthiazol-3-ium-3-yl)-1-piperidino-ethanone bromide Formula: C12H19BrN2OS MolecularWeight: 319.26106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=[N+]1CC(=O)N2CCCCC2)C.[Br-]

Isomeric SMILES

CC1=C(SC=[N+]1CC(=O)N2CCCCC2)C.[Br-]

InChI

InChI=1S/C12H19N2OS.BrH/c1-10-11(2)16-9-14(10)8-12(15)13-6-4-3-5-7-13;/h9H,3-8H2,1-2H3;1H/q+1;/p-1