2-(1,1-dimethylpiperidin-1-ium-2-yl)-1,1-diphenyl-ethanol bromide

Systemtic Name: 2-(1,1-dimethylpiperidin-1-ium-2-yl)-1,1-diphenyl-ethanol bromide Openeye Name: 2-(1,1-dimethylpiperidin-1-ium-2-yl)-1,1-diphenyl-ethanol bromide CAS Name: 2-(1,1-dimethyl-2-piperidin-1-iumyl)-1,1-diphenylethanol bromide IUPAC Name: 2-(1,1-dimethylpiperidin-1-ium-2-yl)-1,1-diphenylethanol bromide Traditional Name: 2-(1,1-dimethylpiperidin-1-ium-2-yl)-1,1-diphenyl-ethanol bromide Formula: C21H28BrNO MolecularWeight: 390.35712

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1CC(C2=CC=CC=C2)(C3=CC=CC=C3)O)C.[Br-]

Isomeric SMILES

C[N+]1(CCCCC1CC(C2=CC=CC=C2)(C3=CC=CC=C3)O)C.[Br-]

InChI

InChI=1S/C21H28NO.BrH/c1-22(2)16-10-9-15-20(22)17-21(23,18-11-5-3-6-12-18)19-13-7-4-8-14-19;/h3-8,11-14,20,23H,9-10,15-17H2,1-2H3;1H/q+1;/p-1