2-(2-dimethylazaniumylideneazetidin-1-ium-1-yl)ethylidene-(3-formamidobutyl)-methyl-azanium dichloride

Systemtic Name: 2-(2-dimethylazaniumylideneazetidin-1-ium-1-yl)ethylidene-(3-formamidobutyl)-methyl-azanium dichloride Openeye Name: 2-(2-dimethyliminioazetidin-1-ium-1-yl)ethylidene-(3-formamidobutyl)-methyl-ammonium dichloride CAS Name: 2-(2-dimethyliminio-1-azetidin-1-iumyl)ethylidene-(3-formamidobutyl)-methylammonium dichloride IUPAC Name: 2-(2-dimethylazaniumylideneazetidin-1-ium-1-yl)ethylidene-(3-formamidobutyl)-methylazanium dichloride Traditional Name: 2-(2-dimethyliminioazetidin-1-ium-1-yl)ethylidene-(3-formamidobutyl)-methyl-ammonium dichloride Formula: C13H27Cl2N4O+ MolecularWeight: 326.28568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC[N+](=CC[NH+]1CCC1=[N+](C)C)C)NC=O.[Cl-].[Cl-]

Isomeric SMILES

CC(CC[N+](=CC[NH+]1CCC1=[N+](C)C)C)NC=O.[Cl-].[Cl-]

InChI

InChI=1S/C13H25N4O.2ClH/c1-12(14-11-18)5-7-16(4)9-10-17-8-6-13(17)15(2)3;;/h9,11-12H,5-8,10H2,1-4H3;2*1H/q+1;;