12-pyridin-1-ium-1-yldodecane-1,11-diol bromide

Systemtic Name: 12-pyridin-1-ium-1-yldodecane-1,11-diol bromide Openeye Name: 12-pyridin-1-ium-1-yldodecane-1,11-diol bromide CAS Name: 12-(1-pyridin-1-iumyl)dodecane-1,11-diol bromide IUPAC Name: 12-pyridin-1-ium-1-yldodecane-1,11-diol bromide Traditional Name: 12-pyridin-1-ium-1-yldodecane-1,11-diol bromide Formula: C17H30BrNO2 MolecularWeight: 360.3296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC(CCCCCCCCCCO)O.[Br-]

Isomeric SMILES

C1=CC=[N+](C=C1)CC(CCCCCCCCCCO)O.[Br-]

InChI

InChI=1S/C17H30NO2.BrH/c19-15-11-6-4-2-1-3-5-8-12-17(20)16-18-13-9-7-10-14-18;/h7,9-10,13-14,17,19-20H,1-6,8,11-12,15-16H2;1H/q+1;/p-1