Chem
J-GLOBAL ID:200907056187637053   Nikkaji number:J1.703.689K

α,α-Bis(1-phenyl-2-oxo-1,2-dihydrocyclohepta[b]pyrrole-3-yl)-α′,α′,α′′,α′′-tetrakis(1-methyl-2-oxo-1,2-dihydrocyclohepta[b]pyrrole-3-yl)benzene-1,3,5-trimethylium

α,α-ビス(1-フェニル-2-オキソ-1,2-ジヒドロシクロヘプタ[b]ピロール-3-イル)-α′,α′,α′′,α′′-テトラキス(1-メチル-2-オキソ-1,2-ジヒドロシクロヘプタ[b]ピロール-3-イル)ベンゼン-1,3,5-トリメチリウム
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: C76[C+]3H55N6O6
Molecular formula furigana: C79-H55-N6-O6
Molecular weight: 1184.343
InChI: InChI=1S/C79H55N6O6/c1-80-59-39-23-7-17-33-53(59)68(74(80)86)65(69-54-34-18-8-24-40-60(54)81(2)75(69)87)48-45-49(66(70-55-35-19-9-25-41-61(55)82(3)76(70)88)71-56-36-20-10-26-42-62(56)83(4)77(71)89)47-50(46-48)67(72-57-37-21-11-27-43-63(57)84(78(72)90)51-29-13-5-14-30-51)73-58-38-22-12-28-44-64(58)85(79(73)91)52-31-15-6-16-32-52/h5-47H,1-4H3/q+3
InChI key: XOWBWOQFHUIIFL-UHFFFAOYSA-N
SMILES: Cn1c2cccccc2c([C+](c2c3cccccc3n(C)c2=O)c2cc(cc(c2)[C+](c2c3cccccc3n(c3ccccc3)c2=O)c2c3cccccc3n(c3ccccc3)c2=O)[C+](c2c3cccccc3n(C)c2=O)c2c3cccccc3n(C)c2=O)c1=O
Systematic name  (4):
  • 1-[[ビス(1-フェニル-2-オキソ-1,2-ジヒドロシクロヘプタ[b]ピロール-3-イル)メチリウム]-α-イル]-3,5-ビス[[ビス(1-メチル-2-オキソ-1,2-ジヒドロシクロヘプタ[b]ピロール-3-イル)メチリウム]-α-イル]ベンゼン
  • α,α-ビス(1-フェニル-2-オキソ-1,2-ジヒドロシクロヘプタ[b]ピロール-3-イル)-α′,α′,α′′,α′′-テトラキス(1-メチル-2-オキソ-1,2-ジヒドロシクロヘプタ[b]ピロール-3-イル)ベンゼン-1,3,5-トリメチリウム
  • {3-[ビス({1-メチル-2-オキソ-1H,2H-シクロヘプタ[b]ピロール-3-イル})メチリウミル]-5-[ビス({2-オキソ-1-フェニル-1H,2H-シクロヘプタ[b]ピロール-3-イル})メチリウミル]フェニル}ビス({1-メチル-2-オキソ-1H,2H-シクロヘプタ[b]ピロール-3-イル})メチリウム
  • {3-[bis({1-methyl-2-oxo-1H,2H-cyclohepta[b]pyrrol-3-yl})methyliumyl]-5-[bis({2-oxo-1-phenyl-1H,2H-cyclohepta[b]pyrrol-3-yl})methyliumyl]phenyl}bis({1-methyl-2-oxo-1H,2H-cyclohepta[b]pyrrol-3-yl})methylium
Other name (2):
  • 1-[[Bis(1-phenyl-2-oxo-1,2-dihydrocyclohepta[b]pyrrole-3-yl)methylium]-α-yl]-3,5-bis[[bis(1-methyl-2-oxo-1,2-dihydrocyclohepta[b]pyrrole-3-yl)methylium]-α-yl]benzene
  • α,α-Bis(1-phenyl-2-oxo-1,2-dihydrocyclohepta[b]pyrrole-3-yl)-α′,α′,α′′,α′′-tetrakis(1-methyl-2-oxo-1,2-dihydrocyclohepta[b]pyrrole-3-yl)benzene-1,3,5-trimethylium
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