Chem
J-GLOBAL ID：201507017083365534   Nikkaji number：J3.398.665C

((6S,6aS,9R,10R,10aR)-6,9-Di(p-nitrophenyl)-8-formyl-6a,9,10,10a-tetrahydro-6H-dibenzo[b,d]pyran-10-yl)-2-oxoacetic acid ethyl ester

((6S,6aS,9R,10R,10aR)-6,9-ジ(p-ニトロフェニル)-8-ホルミル-6a,9,10,10a-テトラヒドロ-6H-ジベンゾ[b,d]ピラン-10-イル)-2-オキソ酢酸エチル
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： C30H24[N+]2O7[O-]2
Molecular formula furigana： C30-H24-N2-O9
Molecular weight： 556.527
InChI： InChI=1S/C30H24N2O9/c1-2-40-30(35)28(34)27-25(17-7-11-20(12-8-17)31(36)37)19(16-33)15-23-26(27)22-5-3-4-6-24(22)41-29(23)18-9-13-21(14-10-18)32(38)39/h3-16,23,25-27,29H,2H2,1H3/t23-,25+,26+,27-,29+/m0/s1
InChI key： FJBRHARRDJXNPZ-OBOYRTFISA-N
SMILES： CCOC(=O)C(=O)[C@@H]1[C@H]2[C@H](C=C(C=O)[C@H]1c1ccc(cc1)[N+](=O)[O-])[C@H](Oc1ccccc21)c1ccc(cc1)[N+](=O)[O-]
Systematic name  (3)：
  • ((6S,6aS,9R,10R,10aR)-6,9-ジ(p-ニトロフェニル)-8-ホルミル-6a,9,10,10a-テトラヒドロ-6H-ジベンゾ[b,d]ピラン-10-イル)-2-オキソ酢酸エチル
  • エチル 2-[(6S,6aS,9R,10R,10aR)-8-ホルミル-6,9-ビス(4-ニトロフェニル)-6H,6aH,9H,10H,10aH-ベンゾ[c]イソクロメン-10-イル]-2-オキソアセタート
  • ethyl 2-[(6S,6aS,9R,10R,10aR)-8-formyl-6,9-bis(4-nitrophenyl)-6H,6aH,9H,10H,10aH-benzo[c]isochromen-10-yl]-2-oxoacetate
Other name (1)：
  • ((6S,6aS,9R,10R,10aR)-6,9-Di(p-nitrophenyl)-8-formyl-6a,9,10,10a-tetrahydro-6H-dibenzo[b,d]pyran-10-yl)-2-oxoacetic acid ethyl ester
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