Chem
J-GLOBAL ID：200907098214684985   Nikkaji number：J1.947.851C

(2Z,4Z)-2,4-Hexadienedioic acid bis(4-nitrobenzyl) ester

(2Z,4Z)-2,4-ヘキサジエン二酸ビス(4-ニトロベンジル)
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： C20H16[N+]2O6[O-]2
Molecular formula furigana： C20-H16-N2-O8
Molecular weight： 412.354
InChI： InChI=1S/C20H16N2O8/c23-19(29-13-15-5-9-17(10-6-15)21(25)26)3-1-2-4-20(24)30-14-16-7-11-18(12-8-16)22(27)28/h1-12H,13-14H2/b3-1-,4-2-
InChI key： BRLKVJXJZYVZSP-CCAGOZQPSA-N
SMILES： [O-][N+](=O)c1ccc(COC(=O)/C=C\C=C/C(=O)OCc2ccc(cc2)[N+](=O)[O-])cc1
Systematic name  (3)：
  • (2Z,4Z)-2,4-ヘキサジエン二酸ビス(4-ニトロベンジル)
  • 1,6-ビス[(4-ニトロフェニル)メチル] (2Z,4Z)-ヘキサ-2,4-ジエンジオアート
  • 1,6-bis[(4-nitrophenyl)methyl] (2Z,4Z)-hexa-2,4-dienedioate
Other name (1)：
  • (2Z,4Z)-2,4-Hexadienedioic acid bis(4-nitrobenzyl) ester
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