Chem
J-GLOBAL ID：201807017474632563   Nikkaji number：J3.720.783G

N,N,N-Trimethyl-4-[[3,4,5-tris(octyloxy)benzoyl]amino]benzeneaminium

N,N,N-トリメチル-4-[3,4,5-トリス(オクチルオキシ)ベンズアミド]アニリニウム
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： C40H67N[N+]O4
Molecular formula furigana： C40-H67-N2-O4
Molecular weight： 639.985
InChI： InChI=1S/C40H66N2O4/c1-7-10-13-16-19-22-29-44-37-32-34(40(43)41-35-25-27-36(28-26-35)42(4,5)6)33-38(45-30-23-20-17-14-11-8-2)39(37)46-31-24-21-18-15-12-9-3/h25-28,32-33H,7-24,29-31H2,1-6H3/p+1
InChI key： GEDIYWBXMXTYRC-UHFFFAOYSA-O
SMILES： CCCCCCCCOc1cc(cc(OCCCCCCCC)c1OCCCCCCCC)C(=O)Nc1ccc(cc1)[N+](C)(C)C
Systematic name  (3)：
  • N,N,N-トリメチル-4-[[3,4,5-トリス(オクチルオキシ)ベンゾイル]アミノ]ベンゼンアミニウム
  • N,N,N-トリメチル-4-[3,4,5-トリス(オクチルオキシ)ベンズアミド]アニリニウム
  • N,N,N-trimethyl-4-[3,4,5-tris(octyloxy)benzamido]anilinium
Other name (1)：
  • N,N,N-Trimethyl-4-[[3,4,5-tris(octyloxy)benzoyl]amino]benzeneaminium
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