2-(2-heptadecyl-1-methyl-4,5-dihydroimidazol-1-ium-1-yl)ethanol; methyl sulfate

Systemtic Name: 2-(2-heptadecyl-1-methyl-4,5-dihydroimidazol-1-ium-1-yl)ethanol; methyl sulfate Openeye Name: 2-(2-heptadecyl-1-methyl-4,5-dihydroimidazol-1-ium-1-yl)ethanol; methyl sulfate CAS Name: 2-(2-heptadecyl-1-methyl-4,5-dihydroimidazol-1-ium-1-yl)ethanol; methyl sulfate IUPAC Name: 2-(2-heptadecyl-1-methyl-4,5-dihydroimidazol-1-ium-1-yl)ethanol; methyl sulfate Traditional Name: 2-(2-heptadecyl-1-methyl-2-imidazolin-1-ium-1-yl)ethanol; methyl sulfate Formula: C24H50N2O5S MolecularWeight: 478.7292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=NCC[N+]1(C)CCO.COS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=NCC[N+]1(C)CCO.COS(=O)(=O)[O-]

InChI

InChI=1S/C23H47N2O.CH4O4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-24-19-20-25(23,2)21-22-26;1-5-6(2,3)4/h26H,3-22H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1