Chem
J-GLOBAL ID：200907087011335274   Nikkaji number：J1.004.463D

8-Hexyl-12-bromo-5,6-dihydro-9,10-dimethoxybenzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium

8-ヘキシル-12-ブロモ-5,6-ジヒドロ-9,10-ジメトキシベンゾ[g]-1,3-ベンゾジオキソロ[5,6-a]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： C26H29Br[N+]O4
Molecular formula furigana： C26-H29-BR-N-O4
Molecular weight： 499.424
InChI： InChI=1S/C26H29BrNO4/c1-4-5-6-7-8-20-25-18(19(27)14-24(29-2)26(25)30-3)12-21-17-13-23-22(31-15-32-23)11-16(17)9-10-28(20)21/h11-14H,4-10,15H2,1-3H3/q+1
InChI key： UPENJRZYFIYLJH-UHFFFAOYSA-N
SMILES： CCCCCCc1[n+]2CCc3cc4OCOc4cc3c2cc2c(Br)cc(OC)c(OC)c12
Systematic name  (4)：
  • 8-ヘキシル-12-ブロモ-5,6-ジヒドロ-9,10-ジメトキシベンゾ[g]-1,3-ベンゾジオキソロ[5,6-a]キノリジニウム
  • 8-ヘキシル-9,10-ジメトキシ-12-ブロモ-5,6-ジヒドロベンゾ[g]-1,3-ベンゾジオキソロ[5,6-a]キノリジニウム
  • 19-ブロモ-14-ヘキシル-16,17-ジメトキシ-5,7-ジオキサ-13λ5-アザペンタシクロ[11.8.0.02,10.04,8.015,20]ヘンイコサ-1(13),2,4(8),9,14,16,18,20-オクタエン-13-イリウム
  • 19-bromo-14-hexyl-16,17-dimethoxy-5,7-dioxa-13λ5-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaen-13-ylium
Other name (2)：
  • 8-Hexyl-12-bromo-5,6-dihydro-9,10-dimethoxybenzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium
  • 8-Hexyl-9,10-dimethoxy-12-bromo-5,6-dihydrobenzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium
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