1-(4-bromophenyl)-3-piperidin-1-ium-1-yl-propan-2-ol bromide

Systemtic Name: 1-(4-bromophenyl)-3-piperidin-1-ium-1-yl-propan-2-ol bromide Openeye Name: 1-(4-bromophenyl)-3-piperidin-1-ium-1-yl-propan-2-ol bromide CAS Name: 1-(4-bromophenyl)-3-(1-piperidin-1-iumyl)-2-propanol bromide IUPAC Name: 1-(4-bromophenyl)-3-piperidin-1-ium-1-ylpropan-2-ol bromide Traditional Name: 1-(4-bromophenyl)-3-piperidin-1-ium-1-yl-propan-2-ol bromide Formula: C14H21Br2NO MolecularWeight: 379.13064

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(CC2=CC=C(C=C2)Br)O.[Br-]

Isomeric SMILES

C1CC[NH+](CC1)CC(CC2=CC=C(C=C2)Br)O.[Br-]

InChI

InChI=1S/C14H20BrNO.BrH/c15-13-6-4-12(5-7-13)10-14(17)11-16-8-2-1-3-9-16;/h4-7,14,17H,1-3,8-11H2;1H