disodium 2-[1-(2-oxidanidyl-2-oxidanylidene-ethyl)-2-undecyl-4,5-dihydroimidazol-1-ium-1-yl]ethanoate chloride

Systemtic Name: disodium 2-[1-(2-oxidanidyl-2-oxidanylidene-ethyl)-2-undecyl-4,5-dihydroimidazol-1-ium-1-yl]ethanoate chloride Openeye Name: disodium 2-[1-(2-oxido-2-oxo-ethyl)-2-undecyl-4,5-dihydroimidazol-1-ium-1-yl]acetate chloride CAS Name: disodium 2-[1-(2-oxido-2-oxoethyl)-2-undecyl-4,5-dihydroimidazol-1-ium-1-yl]acetate chloride IUPAC Name: disodium 2-[1-(2-oxido-2-oxoethyl)-2-undecyl-4,5-dihydroimidazol-1-ium-1-yl]acetate chloride Traditional Name: disodium 2-[1-(2-keto-2-oxido-ethyl)-2-undecyl-2-imidazolin-1-ium-1-yl]acetate chloride Formula: C18H31ClN2Na2O4 MolecularWeight: 420.88228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=NCC[N+]1(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Cl-]

Isomeric SMILES

CCCCCCCCCCCC1=NCC[N+]1(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Cl-]

InChI

InChI=1S/C18H32N2O4.ClH.2Na/c1-2-3-4-5-6-7-8-9-10-11-16-19-12-13-20(16,14-17(21)22)15-18(23)24;;;/h2-15H2,1H3,(H-,21,22,23,24);1H;;/q;;2*+1/p-2