tributyl-[10-[[3-(dimethylcarbamoyloxy)pyridin-2-yl]carbonyl-dimethyl-azaniumyl]decyl]azanium dibromide

Systemtic Name: tributyl-[10-[[3-(dimethylcarbamoyloxy)pyridin-2-yl]carbonyl-dimethyl-azaniumyl]decyl]azanium dibromide Openeye Name: tributyl-[10-[[3-(dimethylcarbamoyloxy)pyridine-2-carbonyl]-dimethyl-ammonio]decyl]ammonium dibromide CAS Name: tributyl-[10-[[[3-[dimethylamino(oxo)methoxy]-2-pyridinyl]-oxomethyl]-dimethylammonio]decyl]ammonium dibromide IUPAC Name: tributyl-[10-[[3-(dimethylcarbamoyloxy)pyridine-2-carbonyl]-dimethylazaniumyl]decyl]azanium dibromide Traditional Name: tributyl-[10-[[3-(dimethylcarbamoyloxy)picolinoyl]-dimethyl-ammonio]decyl]ammonium dibromide Formula: C33H62Br2N4O3 MolecularWeight: 722.67838

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCCCCCCCC[N+](C)(C)C(=O)C1=C(C=CC=N1)OC(=O)N(C)C.[Br-].[Br-]

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCCCCCCCC[N+](C)(C)C(=O)C1=C(C=CC=N1)OC(=O)N(C)C.[Br-].[Br-]

InChI

InChI=1S/C33H62N4O3.2BrH/c1-8-11-26-37(27-12-9-2,28-13-10-3)29-21-19-17-15-14-16-18-20-25-36(6,7)32(38)31-30(23-22-24-34-31)40-33(39)35(4)5;;/h22-24H,8-21,25-29H2,1-7H3;2*1H/q+2;;/p-2