trimethyl-[2-[4-[2-(trimethylazaniumyl)ethoxycarbonyl]phenyl]carbonyloxyethyl]azanium dibromide

Systemtic Name: trimethyl-[2-[4-[2-(trimethylazaniumyl)ethoxycarbonyl]phenyl]carbonyloxyethyl]azanium dibromide Openeye Name: trimethyl-[2-[4-[2-(trimethylammonio)ethoxycarbonyl]benzoyl]oxyethyl]ammonium dibromide CAS Name: trimethyl-[2-[oxo-[4-[oxo-[2-(trimethylammonio)ethoxy]methyl]phenyl]methoxy]ethyl]ammonium dibromide IUPAC Name: trimethyl-[2-[4-[2-(trimethylazaniumyl)ethoxycarbonyl]benzoyl]oxyethyl]azanium dibromide Traditional Name: trimethyl-[2-[4-[2-(trimethylammonio)ethoxycarbonyl]benzoyl]oxyethyl]ammonium dibromide Formula: C18H30Br2N2O4 MolecularWeight: 498.2498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H30N2O4.2BrH/c1-19(2,3)11-13-23-17(21)15-7-9-16(10-8-15)18(22)24-14-12-20(4,5)6;;/h7-10H,11-14H2,1-6H3;2*1H/q+2;;/p-2