Chem
J-GLOBAL ID：200907017269559209
Nikkaji number：J1.004.460J
8-Ethyl-12-bromo-5,6-dihydro-9,10-dimethoxybenzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium
8-エチル-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 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
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
Molecular formula： C22H21Br[N+]O4
Molecular formula furigana： C22-H21-BR-N-O4
Molecular weight： 443.316
InChI：
InChI=1S/C22H21BrNO4/c1-4-16-21-14(15(23)10-20(25-2)22(21)26-3)8-17-13-9-19-18(27-11-28-19)7-12(13)5-6-24(16)17/h7-10H,4-6,11H2,1-3H3/q+1
InChI key：
CQCATAMJAYJADC-UHFFFAOYSA-N
SMILES：
CCc1[n+]2CCc3cc4OCOc4cc3c2cc2c(Br)cc(OC)c(OC)c12
Systematic name (3)：
- 8-エチル-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
- 19-ブロモ-14-エチル-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-ethyl-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
- 8-Ethyl-12-bromo-5,6-dihydro-9,10-dimethoxybenzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium
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