Chem
J-GLOBAL ID:200907000662592056   Nikkaji number:J276.790B

5,7-Bis(ethoxycarbonyl)-2,6-dimethyl-3-(phenyl)-1H-pyrrolo[1,2-c]imidazol-2-ium

5,7-ビス(エトキシカルボニル)-2,6-ジメチル-3-フェニル-1H-ピロロ[1,2-c]イミダゾール-2-イウム
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: C20H23N[N+]O4
Molecular formula furigana: C20-H23-N2-O4
Molecular weight: 355.413
InChI: InChI=1S/C20H23N2O4/c1-5-25-19(23)16-13(3)17(20(24)26-6-2)22-15(16)12-21(4)18(22)14-10-8-7-9-11-14/h7-11H,5-6,12H2,1-4H3/q+1
InChI key: XDPUGRJEHYYFAP-UHFFFAOYSA-N
SMILES: CCOC(=O)c1c(C)c(C(=O)OCC)n2C(=[N+](C)Cc12)c1ccccc1
Systematic name  (3):
  • 5,7-ビス(エトキシカルボニル)-2,6-ジメチル-3-(フェニル)-1H-ピロロ[1,2-c]イミダゾール-2-イウム
  • 5,7-ビス(エトキシカルボニル)-2,6-ジメチル-3-フェニル-1H-ピロロ[1,2-c]イミダゾール-2-イウム
  • 5,7-bis(ethoxycarbonyl)-2,6-dimethyl-3-phenyl-1H-pyrrolo[1,2-c]imidazol-2-ium
Other name (1):
  • 5,7-Bis(ethoxycarbonyl)-2,6-dimethyl-3-(phenyl)-1H-pyrrolo[1,2-c]imidazol-2-ium
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