[2-(dimethylcarbamoyloxy)phenyl]methyl-dimethyl-[8-(trimethylazaniumyl)octyl]azanium dinitrate

Systemtic Name: [2-(dimethylcarbamoyloxy)phenyl]methyl-dimethyl-[8-(trimethylazaniumyl)octyl]azanium dinitrate Openeye Name: [2-(dimethylcarbamoyloxy)phenyl]methyl-dimethyl-[8-(trimethylammonio)octyl]ammonium dinitrate CAS Name: [2-[dimethylamino(oxo)methoxy]phenyl]methyl-dimethyl-[8-(trimethylammonio)octyl]ammonium dinitrate IUPAC Name: [2-(dimethylcarbamoyloxy)phenyl]methyl-dimethyl-[8-(trimethylazaniumyl)octyl]azanium dinitrate Traditional Name: [2-(dimethylcarbamoyloxy)benzyl]-dimethyl-[8-(trimethylammonio)octyl]ammonium dinitrate Formula: C23H43N5O8 MolecularWeight: 517.61622

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)OC1=CC=CC=C1C[N+](C)(C)CCCCCCCC[N+](C)(C)C.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-]

Isomeric SMILES

CN(C)C(=O)OC1=CC=CC=C1C[N+](C)(C)CCCCCCCC[N+](C)(C)C.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-]

InChI

InChI=1S/C23H43N3O2.2NO3/c1-24(2)23(27)28-22-17-13-12-16-21(22)20-26(6,7)19-15-11-9-8-10-14-18-25(3,4)5;2*2-1(3)4/h12-13,16-17H,8-11,14-15,18-20H2,1-7H3;;/q+2;2*-1