1-(3-ethyl-4,5-dihydroimidazol-3-ium-1-yl)-17-methyl-octadecan-1-ol; ethyl sulfate

Systemtic Name: 1-(3-ethyl-4,5-dihydroimidazol-3-ium-1-yl)-17-methyl-octadecan-1-ol; ethyl sulfate Openeye Name: 1-(3-ethyl-4,5-dihydroimidazol-3-ium-1-yl)-17-methyl-octadecan-1-ol; ethyl sulfate CAS Name: 1-(3-ethyl-4,5-dihydroimidazol-3-ium-1-yl)-17-methyl-1-octadecanol; ethyl sulfate IUPAC Name: 1-(3-ethyl-4,5-dihydroimidazol-3-ium-1-yl)-17-methyloctadecan-1-ol; ethyl sulfate Traditional Name: 1-(3-ethyl-2-imidazolin-3-ium-1-yl)-17-methyl-octadecan-1-ol; ethyl sulfate Formula: C26H54N2O5S MolecularWeight: 506.78236

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CN(CC1)C(CCCCCCCCCCCCCCCC(C)C)O.CCOS(=O)(=O)[O-]

Isomeric SMILES

CC[N+]1=CN(CC1)C(CCCCCCCCCCCCCCCC(C)C)O.CCOS(=O)(=O)[O-]

InChI

InChI=1S/C24H49N2O.C2H6O4S/c1-4-25-20-21-26(22-25)24(27)19-17-15-13-11-9-7-5-6-8-10-12-14-16-18-23(2)3;1-2-6-7(3,4)5/h22-24,27H,4-21H2,1-3H3;2H2,1H3,(H,3,4,5)/q+1;/p-1