Chem
J-GLOBAL ID：201807007846508311   Nikkaji number：J3.718.216H

N,N′,N′′-Tris[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl)phenyl]-1,3,5-benzenetricarboxamide

N,N′,N′′-トリス[2-(4,4,5,5-テトラメチル-1,3,2-ジオキサボロラン-2-イル)フェニル]-1,3,5-ベンゼントリカルボアミド
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： C45H54B3N3O9
Molecular formula furigana： C45-H54-B3-N3-O9
Molecular weight： 813.370
InChI： InChI=1S/C45H54B3N3O9/c1-40(2)41(3,4)56-46(55-40)31-19-13-16-22-34(31)49-37(52)28-25-29(38(53)50-35-23-17-14-20-32(35)47-57-42(5,6)43(7,8)58-47)27-30(26-28)39(54)51-36-24-18-15-21-33(36)48-59-44(9,10)45(11,12)60-48/h13-27H,1-12H3,(H,49,52)(H,50,53)(H,51,54)
InChI key： IRPRCCRVYRYNRD-UHFFFAOYSA-N
SMILES： CC1(C)OB(OC1(C)C)c1ccccc1NC(=O)c1cc(cc(c1)C(=O)Nc1ccccc1B1OC(C)(C)C(C)(C)O1)C(=O)Nc1ccccc1B1OC(C)(C)C(C)(C)O1
Systematic name  (3)：
  • N,N′,N′′-トリス[2-(4,4,5,5-テトラメチル-1,3,2-ジオキサボロラン-2-イル)フェニル]-1,3,5-ベンゼントリカルボアミド
  • N1,N3,N5-トリス[2-(4,4,5,5-テトラメチル-1,3,2-ジオキサボロラン-2-イル)フェニル]ベンゼン-1,3,5-トリカルボキサミド
  • N1,N3,N5-tris[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]benzene-1,3,5-tricarboxamide
Other name (1)：
  • N,N′,N′′-Tris[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl)phenyl]-1,3,5-benzenetricarboxamide
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