Chem
J-GLOBAL ID:200907003309777513   Nikkaji number:J1.770.547D

7-Bromo-4-methyl-2-(2-bromo-4-methylphenyl)-5-nitro-5,7a-epoxyoctahydro-1H-isoindole

7-ブロモ-4-メチル-2-(2-ブロモ-4-メチルフェニル)-5-ニトロ-5,7a-エポキシオクタヒドロ-1H-イソインドール
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: C16H18Br2N[N+]O2[O-]
Molecular formula furigana: C16-H18-BR2-N2-O3
Molecular weight: 446.139
InChI: InChI=1S/C16H18Br2N2O3/c1-9-3-4-13(12(17)5-9)19-7-11-10(2)16(20(21)22)6-14(18)15(11,8-19)23-16/h3-5,10-11,14H,6-8H2,1-2H3
InChI key: LQERPLQPBZRIJY-UHFFFAOYSA-N
SMILES: CC1C2CN(CC32OC1(CC3Br)[N+](=O)[O-])c1ccc(C)cc1Br
Systematic name  (3):
  • 7-ブロモ-4-メチル-2-(2-ブロモ-4-メチルフェニル)-5-ニトロ-5,7a-エポキシオクタヒドロ-1H-イソインドール
  • 9-ブロモ-3-(2-ブロモ-4-メチルフェニル)-6-メチル-7-ニトロ-10-オキサ-3-アザトリシクロ[5.2.1.01,5]デカン
  • 9-bromo-3-(2-bromo-4-methylphenyl)-6-methyl-7-nitro-10-oxa-3-azatricyclo[5.2.1.01,5]decane
Other name (1):
  • 7-Bromo-4-methyl-2-(2-bromo-4-methylphenyl)-5-nitro-5,7a-epoxyoctahydro-1H-isoindole
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