2-(2-octadecyl-4,5-dihydroimidazol-1-yl)ethanoic acid; 2-(trimethylazaniumyl)ethanoate

Systemtic Name: 2-(2-octadecyl-4,5-dihydroimidazol-1-yl)ethanoic acid; 2-(trimethylazaniumyl)ethanoate Openeye Name: 2-(2-octadecyl-4,5-dihydroimidazol-1-yl)acetic acid; 2-(trimethylammonio)acetate CAS Name: 2-(2-octadecyl-4,5-dihydroimidazol-1-yl)acetic acid; 2-(trimethylammonio)acetate IUPAC Name: 2-(2-octadecyl-4,5-dihydroimidazol-1-yl)acetic acid; 2-(trimethylazaniumyl)acetate Traditional Name: 2-(2-stearyl-2-imidazolin-1-yl)acetic acid; 2-(trimethylammonio)acetate Formula: C28H55N3O4 MolecularWeight: 497.754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=NCCN1CC(=O)O.C[N+](C)(C)CC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=NCCN1CC(=O)O.C[N+](C)(C)CC(=O)[O-]

InChI

InChI=1S/C23H44N2O2.C5H11NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-24-19-20-25(22)21-23(26)27;1-6(2,3)4-5(7)8/h2-21H2,1H3,(H,26,27);4H2,1-3H3