2-[1-[(2-chlorophenyl)methyl]-1-methyl-piperidin-1-ium-3-yl]carbonyloxyethyl-trimethyl-azanium bromide

Systemtic Name: 2-[1-[(2-chlorophenyl)methyl]-1-methyl-piperidin-1-ium-3-yl]carbonyloxyethyl-trimethyl-azanium bromide Openeye Name: 2-[1-[(2-chlorophenyl)methyl]-1-methyl-piperidin-1-ium-3-carbonyl]oxyethyl-trimethyl-ammonium bromide CAS Name: 2-[[1-[(2-chlorophenyl)methyl]-1-methyl-3-piperidin-1-iumyl]-oxomethoxy]ethyl-trimethylammonium bromide IUPAC Name: 2-[1-[(2-chlorophenyl)methyl]-1-methylpiperidin-1-ium-3-carbonyl]oxyethyl-trimethylazanium bromide Traditional Name: 2-[1-(2-chlorobenzyl)-1-methyl-piperidin-1-ium-3-carbonyl]oxyethyl-trimethyl-ammonium bromide Formula: C19H31BrClN2O2+ MolecularWeight: 434.81864

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC(C1)C(=O)OCC[N+](C)(C)C)CC2=CC=CC=C2Cl.[Br-]

Isomeric SMILES

C[N+]1(CCCC(C1)C(=O)OCC[N+](C)(C)C)CC2=CC=CC=C2Cl.[Br-]

InChI

InChI=1S/C19H31ClN2O2.BrH/c1-21(2,3)12-13-24-19(23)17-9-7-11-22(4,15-17)14-16-8-5-6-10-18(16)20;/h5-6,8,10,17H,7,9,11-15H2,1-4H3;1H/q+2;/p-1