Chem
J-GLOBAL ID:200907065959207342
Nikkaji number:J1.703.684J
1,3,5-Tris[[bis(2-oxo-2H-cyclohepta[b]furan-3-yl)methylium]-α-yl]benzene
1,3,5-トリス[[ビス(2-オキソ-2H-シクロヘプタ[b]フラン-3-イル)メチリウム]-α-イル]ベンゼン
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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:
C60 [C+]3 H33 O12
Molecular formula furigana:
C63-H33-O12
Molecular weight:
981.943
InChI:
InChI=1S/C63H33O12/c64-58-52(37-19-7-1-13-25-43(37)70-58)49(53-38-20-8-2-14-26-44(38)71-59(53)65)34-31-35(50(54-39-21-9-3-15-27-45(39)72-60(54)66)55-40-22-10-4-16-28-46(40)73-61(55)67)33-36(32-34)51(56-41-23-11-5-17-29-47(41)74-62(56)68)57-42-24-12-6-18-30-48(42)75-63(57)69/h1-33H/q+3
InChI key:
BABYAWSPMQMONV-UHFFFAOYSA-N
SMILES:
O=c1oc2cccccc2c1[C+](c1c2cccccc2oc1=O)c1cc(cc(c1)[C+](c1c2cccccc2oc1=O)c1c2cccccc2oc1=O)[C+](c1c2cccccc2oc1=O)c1c2cccccc2oc1=O
Systematic name (4):
1,3,5-トリス[[ビス(2-オキソ-2H-シクロヘプタ[b]フラン-3-イル)メチリウム]-α-イル]ベンゼン
α,α,α′,α′,α′′,α′′-ヘキサキス(2-オキソ-2H-シクロヘプタ[b]フラン-3-イル)ベンゼン-1,3,5-トリメチリウム
{3,5-ビス[ビス({2-オキソ-2H-シクロヘプタ[b]フラン-3-イル})メチリウミル]フェニル}ビス({2-オキソ-2H-シクロヘプタ[b]フラン-3-イル})メチリウム
{3,5-bis[bis({2-oxo-2H-cyclohepta[b]furan-3-yl})methyliumyl]phenyl}bis({2-oxo-2H-cyclohepta[b]furan-3-yl})methylium
Other name (2):
1,3,5-Tris[[bis(2-oxo-2H-cyclohepta[b]furan-3-yl)methylium]-α-yl]benzene
α,α,α′,α′,α′′,α′′-Hexakis(2-oxo-2H-cyclohepta[b]furan-3-yl)benzene-1,3,5-trimethylium
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