Chem
J-GLOBAL ID:200907003757608129   Nikkaji number:J693.022K

7,10-Dibromo-12,12-bis(3-furyl)-6,11-dihydro-6β,11β-ethanobenzo[b]quinolizinium

7,10-ジブロモ-12,12-ビス(3-フリル)-6,11-ジヒドロ-6β,11β-エタノベンゾ[b]キノリジニウム
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: C23H16Br2[N+]O2
Molecular formula furigana: C23-H16-BR2-N-O2
Molecular weight: 498.193
InChI: InChI=1S/C23H16Br2NO2/c24-16-4-5-17(25)21-20(16)19-11-23(14-6-9-27-12-14,15-7-10-28-13-15)22(21)18-3-1-2-8-26(18)19/h1-10,12-13,19,22H,11H2/q+1/t19-,22-/m0/s1
InChI key: HWMUKYQTXDMCCT-UGKGYDQZSA-N
SMILES: Brc1ccc(Br)c2[C@@H]3c4cccc[n+]4[C@@H](CC3(c3ccoc3)c3ccoc3)c12
Systematic name  (3):
  • 7,10-ジブロモ-12,12-ビス(3-フリル)-6,11-ジヒドロ-6β,11β-エタノベンゾ[b]キノリジニウム
  • (1S,8R)-10,13-ジブロモ-16,16-ビス(フラン-3-イル)-2λ5-アザテトラシクロ[6.6.2.02,7.09,14]ヘキサデカ-2,4,6,9(14),10,12-ヘキサエン-2-イリウム
  • (1S,8R)-10,13-dibromo-16,16-bis(furan-3-yl)-2λ5-azatetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9(14),10,12-hexaen-2-ylium
Other name (1):
  • 7,10-Dibromo-12,12-bis(3-furyl)-6,11-dihydro-6β,11β-ethanobenzo[b]quinolizinium
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