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

Systemtic Name: cyanomethyl-[10-[[3-(dimethylcarbamoyloxy)pyridin-2-yl]carbonyl-dimethyl-azaniumyl]decyl]-dimethyl-azanium dinitrate Openeye Name: cyanomethyl-[10-[[3-(dimethylcarbamoyloxy)pyridine-2-carbonyl]-dimethyl-ammonio]decyl]-dimethyl-ammonium dinitrate CAS Name: cyanomethyl-[10-[[[3-[dimethylamino(oxo)methoxy]-2-pyridinyl]-oxomethyl]-dimethylammonio]decyl]-dimethylammonium dinitrate IUPAC Name: cyanomethyl-[10-[[3-(dimethylcarbamoyloxy)pyridine-2-carbonyl]-dimethylazaniumyl]decyl]-dimethylazanium dinitrate Traditional Name: cyanomethyl-[10-[[3-(dimethylcarbamoyloxy)picolinoyl]-dimethyl-ammonio]decyl]-dimethyl-ammonium dinitrate Formula: C25H43N7O9 MolecularWeight: 585.65042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)OC1=C(N=CC=C1)C(=O)[N+](C)(C)CCCCCCCCCC[N+](C)(C)CC#N.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-]

Isomeric SMILES

CN(C)C(=O)OC1=C(N=CC=C1)C(=O)[N+](C)(C)CCCCCCCCCC[N+](C)(C)CC#N.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-]

InChI

InChI=1S/C25H43N5O3.2NO3/c1-28(2)25(32)33-22-16-15-18-27-23(22)24(31)30(5,6)20-14-12-10-8-7-9-11-13-19-29(3,4)21-17-26;2*2-1(3)4/h15-16,18H,7-14,19-21H2,1-6H3;;/q+2;2*-1