Chem
J-GLOBAL ID:200907048558232466   Nikkaji number:J2.616.451F

4′-[Di-tert-butyl[[(2E,6E,10E)-3,7,11,15-tetramethyl-17-(3,3-dimethyloxiranyl)heptadecane-2,6,10,14-tetraenyl]oxy]siloxy]-2,6-dinitrobiphenyl-4-carboxylic acid methyl ester

4′-[ジ-tert-ブチル[[(2E,6E,10E)-3,7,11,15-テトラメチル-17-(3,3-ジメチルオキシラニル)ヘプタデカン-2,6,10,14-テトラエニル]オキシ]シロキシ]-2,6-ジニトロビフェニル-4-カルボン酸メチル
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: C47H68[N+]2O7[O-]2Si
Molecular formula furigana: C47-H68-N2-O9-SI
Molecular weight: 833.151
InChI: InChI=1S/C47H68N2O9Si/c1-33(19-15-21-35(3)23-28-42-47(11,12)57-42)17-14-18-34(2)20-16-22-36(4)29-30-56-59(45(5,6)7,46(8,9)10)58-39-26-24-37(25-27-39)43-40(48(51)52)31-38(44(50)55-13)32-41(43)49(53)54/h17,20-21,24-27,29,31-32,42H,14-16,18-19,22-23,28,30H2,1-13H3/b33-17+,34-20+,35-21?,36-29+
InChI key: DAVJVSHYVSSITQ-AUDWZYJPSA-N
SMILES: COC(=O)c1cc(c(c2ccc(O[Si](OC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)CCC3OC3(C)C)(C(C)(C)C)C(C)(C)C)cc2)c(c1)[N+](=O)[O-])[N+](=O)[O-]
Systematic name  (3):
  • 4′-[ジ-tert-ブチル[[(2E,6E,10E)-3,7,11,15-テトラメチル-17-(3,3-ジメチルオキシラニル)ヘプタデカン-2,6,10,14-テトラエニル]オキシ]シロキシ]-2,6-ジニトロビフェニル-4-カルボン酸メチル
  • メチル 4'-{[ジ-tert-ブチル({[(2E,6E,10E)-17-(3,3-ジメチルオキシラン-2-イル)-3,7,11,15-テトラメチルヘプタデカ-2,6,10,14-テトラエン-1-イル]オキシ})シリル]オキシ}-2,6-ジニトロ-[1,1'-ビフェニル]-4-カルボキシラート
  • methyl 4'-{[di-tert-butyl({[(2E,6E,10E)-17-(3,3-dimethyloxiran-2-yl)-3,7,11,15-tetramethylheptadeca-2,6,10,14-tetraen-1-yl]oxy})silyl]oxy}-2,6-dinitro-[1,1'-biphenyl]-4-carboxylate
Other name (1):
  • 4′-[Di-tert-butyl[[(2E,6E,10E)-3,7,11,15-tetramethyl-17-(3,3-dimethyloxiranyl)heptadecane-2,6,10,14-tetraenyl]oxy]siloxy]-2,6-dinitrobiphenyl-4-carboxylic acid methyl ester
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