Chem
J-GLOBAL ID:200907048481326683   Nikkaji number:J2.600.484E

2,2′-[(E)-1,2-Ethenediyl]bis[13-(methoxymethyl)dithieno[3,2-e:3′,2′-e′]benzo[1,2-b:4,3-b′]bis[1]benzothiophene]

2,2′-[(E)-1,2-エテンジイル]ビス[13-(メトキシメチル)ジチエノ[3,2-e:3′,2′-e′]ベンゾ[1,2-b:4,3-b′]ビス[1]ベンゾチオフェン]
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: C50H28O2S8
Molecular formula furigana: C50-H28-O2-S8
Molecular weight: 917.250
InChI: InChI=1S/C50H28O2S8/c1-51-21-25-19-29-33(55-25)7-11-37-45(29)49-41(59-37)15-13-39-47(49)43-27-17-23(53-31(27)5-9-35(43)57-39)3-4-24-18-28-32(54-24)6-10-36-44(28)48-40(58-36)14-16-42-50(48)46-30-20-26(22-52-2)56-34(30)8-12-38(46)60-42/h3-20H,21-22H2,1-2H3/b4-3+
InChI key: LXZIJUVWOOFZKO-ONEGZZNKSA-N
SMILES: COCc1cc2c(ccc3sc4ccc5sc6ccc7sc(/C=C/c8cc9c(ccc%10sc%11ccc%12sc%13ccc%14sc(COC)cc%14c%13c%12c%11c9%10)s8)cc7c6c5c4c23)s1
Systematic name  (3):
  • 2,2′-[(E)-1,2-エテンジイル]ビス[13-(メトキシメチル)ジチエノ[3,2-e:3′,2′-e′]ベンゾ[1,2-b:4,3-b′]ビス[1]ベンゾチオフェン]
  • 6-(メトキシメチル)-23-[(1E)-2-[23-(メトキシメチル)-7,12,17,22-テトラチアヘプタシクロ[14.10.0.02,13.03,11.04,8.018,26.021,25]ヘキサコサ-1(16),2(13),3,5,8,10,14,18(26),19,21(25),23-ウンデカエン-6-イル]エテニル]-7,12,17,22-テトラチアヘプタシクロ[14.10.0.02,13.03,11.04,8.018,26.021,25]ヘキサコサ-1(16),2(13),3,5,8,10,14,18(26),19,21(25),23-ウンデカエン
  • 6-(methoxymethyl)-23-[(1E)-2-[23-(methoxymethyl)-7,12,17,22-tetrathiaheptacyclo[14.10.0.02,13.03,11.04,8.018,26.021,25]hexacosa-1(16),2(13),3,5,8,10,14,18(26),19,21(25),23-undecaen-6-yl]ethenyl]-7,12,17,22-tetrathiaheptacyclo[14.10.0.02,13.03,11.04,8.018,26.021,25]hexacosa-1(16),2(13),3,5,8,10,14,18(26),19,21(25),23-undecaene
Other name (1):
  • 2,2′-[(E)-1,2-Ethenediyl]bis[13-(methoxymethyl)dithieno[3,2-e:3′,2′-e′]benzo[1,2-b:4,3-b′]bis[1]benzothiophene]
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