1-(4,5-dihydro-1H-imidazol-1-ium-1-yl)dodecan-1-one; 2-(trimethylazaniumyl)ethanoate

Systemtic Name: 1-(4,5-dihydro-1H-imidazol-1-ium-1-yl)dodecan-1-one; 2-(trimethylazaniumyl)ethanoate Openeye Name: 1-(4,5-dihydro-1H-imidazol-1-ium-1-yl)dodecan-1-one; 2-(trimethylammonio)acetate CAS Name: 1-(4,5-dihydro-1H-imidazol-1-ium-1-yl)-1-dodecanone; 2-(trimethylammonio)acetate IUPAC Name: 1-(4,5-dihydro-1H-imidazol-1-ium-1-yl)dodecan-1-one; 2-(trimethylazaniumyl)acetate Traditional Name: 1-(2-imidazolin-1-ium-1-yl)dodecan-1-one; 2-(trimethylammonio)acetate Formula: C20H40N3O3+ MolecularWeight: 370.5499

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)[NH+]1CCN=C1.C[N+](C)(C)CC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC(=O)[NH+]1CCN=C1.C[N+](C)(C)CC(=O)[O-]

InChI

InChI=1S/C15H28N2O.C5H11NO2/c1-2-3-4-5-6-7-8-9-10-11-15(18)17-13-12-16-14-17;1-6(2,3)4-5(7)8/h14H,2-13H2,1H3;4H2,1-3H3/p+1