1-tetradecyl-4-[6-(1-tetradecylpyridin-1-ium-4-yl)oxyhexoxy]pyridin-1-ium dibromide

Systemtic Name: 1-tetradecyl-4-[6-(1-tetradecylpyridin-1-ium-4-yl)oxyhexoxy]pyridin-1-ium dibromide Openeye Name: 1-tetradecyl-4-[6-(1-tetradecylpyridin-1-ium-4-yl)oxyhexoxy]pyridin-1-ium dibromide CAS Name: 1-tetradecyl-4-[6-[(1-tetradecyl-4-pyridin-1-iumyl)oxy]hexoxy]pyridin-1-ium dibromide IUPAC Name: 1-tetradecyl-4-[6-(1-tetradecylpyridin-1-ium-4-yl)oxyhexoxy]pyridin-1-ium dibromide Traditional Name: 1-myristyl-4-[6-(1-myristylpyridin-1-ium-4-yl)oxyhexoxy]pyridin-1-ium dibromide Formula: C44H78Br2N2O2 MolecularWeight: 826.91032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC[N+]1=CC=C(C=C1)OCCCCCCOC2=CC=[N+](C=C2)CCCCCCCCCCCCCC.[Br-].[Br-]

Isomeric SMILES

CCCCCCCCCCCCCC[N+]1=CC=C(C=C1)OCCCCCCOC2=CC=[N+](C=C2)CCCCCCCCCCCCCC.[Br-].[Br-]

InChI

InChI=1S/C44H78N2O2.2BrH/c1-3-5-7-9-11-13-15-17-19-21-23-27-35-45-37-31-43(32-38-45)47-41-29-25-26-30-42-48-44-33-39-46(40-34-44)36-28-24-22-20-18-16-14-12-10-8-6-4-2;;/h31-34,37-40H,3-30,35-36,41-42H2,1-2H3;2*1H/q+2;;/p-2