Chem
J-GLOBAL ID：200907010410846166   Nikkaji number：J1.844.814I

1-Methyl-3-[3,4,5-tris(hexadecyloxy)benzyl]-1H-imidazole-3-ium

1-メチル-3-[3,4,5-トリス(ヘキサデシルオキシ)ベンジル]-1H-イミダゾール-3-イウム
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C59H109N[N+]O3
Molecular formula furigana： C59-H109-N2-O3
Molecular weight： 894.531
InChI： InChI=1S/C59H109N2O3/c1-5-8-11-14-17-20-23-26-29-32-35-38-41-44-49-62-57-52-56(54-61-48-47-60(4)55-61)53-58(63-50-45-42-39-36-33-30-27-24-21-18-15-12-9-6-2)59(57)64-51-46-43-40-37-34-31-28-25-22-19-16-13-10-7-3/h47-48,52-53,55H,5-46,49-51,54H2,1-4H3/q+1
InChI key： LGXMOEDOQLDITN-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCCCCCCOc1cc(Cn2cc[n+](C)c2)cc(OCCCCCCCCCCCCCCCC)c1OCCCCCCCCCCCCCCCC
Systematic name  (4)：
  • 1-[3,4,5-トリス(ヘキサデシルオキシ)ベンジル]-3-メチル-1H-イミダゾール-3-イウム
  • 1-メチル-3-[3,4,5-トリス(ヘキサデシルオキシ)ベンジル]-1H-イミダゾール-3-イウム
  • 3-メチル-1-{[3,4,5-トリス(ヘキサデシルオキシ)フェニル]メチル}-1H-イミダゾール-3-イウム
  • 3-methyl-1-{[3,4,5-tris(hexadecyloxy)phenyl]methyl}-1H-imidazol-3-ium
Other name (2)：
  • 1-[3,4,5-Tris(hexadecyloxy)benzyl]-3-methyl-1H-imidazole-3-ium
  • 1-Methyl-3-[3,4,5-tris(hexadecyloxy)benzyl]-1H-imidazole-3-ium
Thsaurus map：
Thesaurus Map

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