(4-ethoxy-4-oxidanylidene-butyl)-dimethyl-[4-(4-methylquinolin-1-ium-1-yl)butyl]azanium dibromide

Systemtic Name: (4-ethoxy-4-oxidanylidene-butyl)-dimethyl-[4-(4-methylquinolin-1-ium-1-yl)butyl]azanium dibromide Openeye Name: (4-ethoxy-4-oxo-butyl)-dimethyl-[4-(4-methylquinolin-1-ium-1-yl)butyl]ammonium dibromide CAS Name: (4-ethoxy-4-oxobutyl)-dimethyl-[4-(4-methyl-1-quinolin-1-iumyl)butyl]ammonium dibromide IUPAC Name: (4-ethoxy-4-oxobutyl)-dimethyl-[4-(4-methylquinolin-1-ium-1-yl)butyl]azanium dibromide Traditional Name: (4-ethoxy-4-keto-butyl)-dimethyl-[4-(4-methylquinolin-1-ium-1-yl)butyl]ammonium dibromide Formula: C22H34Br2N2O2 MolecularWeight: 518.32556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC[N+](C)(C)CCCC[N+]1=CC=C(C2=CC=CC=C21)C.[Br-].[Br-]

Isomeric SMILES

CCOC(=O)CCC[N+](C)(C)CCCC[N+]1=CC=C(C2=CC=CC=C21)C.[Br-].[Br-]

InChI

InChI=1S/C22H34N2O2.2BrH/c1-5-26-22(25)13-10-18-24(3,4)17-9-8-15-23-16-14-19(2)20-11-6-7-12-21(20)23;;/h6-7,11-12,14,16H,5,8-10,13,15,17-18H2,1-4H3;2*1H/q+2;;/p-2