sodium; 2-ethyl-1-oxidanyl-1-undecyl-4,5-dihydroimidazol-1-ium; 2-(trimethylazaniumyl)ethanoate

Systemtic Name: sodium; 2-ethyl-1-oxidanyl-1-undecyl-4,5-dihydroimidazol-1-ium; 2-(trimethylazaniumyl)ethanoate Openeye Name: sodium; 2-ethyl-1-hydroxy-1-undecyl-4,5-dihydroimidazol-1-ium; 2-(trimethylammonio)acetate CAS Name: sodium; 2-ethyl-1-hydroxy-1-undecyl-4,5-dihydroimidazol-1-ium; 2-(trimethylammonio)acetate IUPAC Name: sodium; 2-ethyl-1-hydroxy-1-undecyl-4,5-dihydroimidazol-1-ium; 2-(trimethylazaniumyl)acetate Traditional Name: sodium; 2-ethyl-1-hydroxy-1-undecyl-2-imidazolin-1-ium; 2-(trimethylammonio)acetate Formula: C21H44N3NaO3+2 MolecularWeight: 409.58213

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC[N+]1(CCN=C1CC)O.C[N+](C)(C)CC(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCC[N+]1(CCN=C1CC)O.C[N+](C)(C)CC(=O)[O-].[Na+]

InChI

InChI=1S/C16H33N2O.C5H11NO2.Na/c1-3-5-6-7-8-9-10-11-12-14-18(19)15-13-17-16(18)4-2;1-6(2,3)4-5(7)8;/h19H,3-15H2,1-2H3;4H2,1-3H3;/q+1;;+1