Chem
J-GLOBAL ID：200907076944240086   Nikkaji number：J2.702.046A

(2S)-1′,3′,3′-Trimethyl-6-nitro-5′,8-bis(2-bromo-2-methylpropanoyloxy)spiro[2H-1-benzopyran-2,2′(3′H)-[1H]indole]

(2S)-1′,3′,3′-トリメチル-6-ニトロ-5′,8-ビス(2-ブロモ-2-メチルプロパノイルオキシ)スピロ[2H-1-ベンゾピラン-2,2′(3′H)-[1H]インドール]
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： C27H28Br2N[N+]O6[O-]
Molecular formula furigana： C27-H28-BR2-N2-O7
Molecular weight： 652.336
InChI： InChI=1S/C27H28Br2N2O7/c1-24(2)18-14-17(36-22(32)25(3,4)28)8-9-19(18)30(7)27(24)11-10-15-12-16(31(34)35)13-20(21(15)38-27)37-23(33)26(5,6)29/h8-14H,1-7H3/t27-/m0/s1
InChI key： VRDBYCQJWMSXIC-MHZLTWQESA-N
SMILES： CN1c2ccc(OC(=O)C(C)(C)Br)cc2C(C)(C)[C@@]21Oc1c(OC(=O)C(C)(C)Br)cc(cc1C=C2)[N+](=O)[O-]
Systematic name  (3)：
  • (2S)-1′,3′,3′-トリメチル-6-ニトロ-5′,8-ビス(2-ブロモ-2-メチルプロパノイルオキシ)スピロ[2H-1-ベンゾピラン-2,2′(3′H)-[1H]インドール]
  • (2S)-5'-[(2-ブロモ-2-メチルプロパノイル)オキシ]-1',3',3'-トリメチル-6-ニトロ-1',3'-ジヒドロスピロ[クロメン-2,2'-インドール]-8-イル 2-ブロモ-2-メチルプロパノアート
  • (2S)-5'-[(2-bromo-2-methylpropanoyl)oxy]-1',3',3'-trimethyl-6-nitro-1',3'-dihydrospiro[chromene-2,2'-indol]-8-yl 2-bromo-2-methylpropanoate
Other name (1)：
  • (2S)-1′,3′,3′-Trimethyl-6-nitro-5′,8-bis(2-bromo-2-methylpropanoyloxy)spiro[2H-1-benzopyran-2,2′(3′H)-[1H]indole]
Thsaurus map：
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