Chem
J-GLOBAL ID：200907074590320327   Nikkaji number：J1.018.696J

2,3,6,7,10,11-Hexakis(4-methoxystyryl)-1,4,5,8,9,12-hexaazatriphenylene

ヘキサキス[2-(4-メトキシフェニル)エテニル]-1,4,5,8,9,12-ヘキサアザトリフェニレン
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： C66H54N6O6
Molecular formula furigana： C66-H54-N6-O6
Molecular weight： 1027.194
InChI： InChI=1S/C66H54N6O6/c1-73-49-25-7-43(8-26-49)19-37-55-56(38-20-44-9-27-50(74-2)28-10-44)68-62-61(67-55)63-65(71-58(40-22-46-13-31-52(76-4)32-14-46)57(69-63)39-21-45-11-29-51(75-3)30-12-45)66-64(62)70-59(41-23-47-15-33-53(77-5)34-16-47)60(72-66)42-24-48-17-35-54(78-6)36-18-48/h7-42H,1-6H3
InChI key： XLYLTHBLWINWLC-UHFFFAOYSA-N
SMILES： COc1ccc(C=Cc2nc3c(nc2C=Cc2ccc(OC)cc2)c2nc(C=Cc4ccc(OC)cc4)c(C=Cc4ccc(OC)cc4)nc2c2nc(C=Cc4ccc(OC)cc4)c(C=Cc4ccc(OC)cc4)nc32)cc1
Systematic name  (3)：
  • 2,3,6,7,10,11-ヘキサキス(4-メトキシスチリル)-1,4,5,8,9,12-ヘキサアザトリフェニレン
  • ヘキサキス[2-(4-メトキシフェニル)エテニル]-1,4,5,8,9,12-ヘキサアザトリフェニレン
  • hexakis[2-(4-methoxyphenyl)ethenyl]-1,4,5,8,9,12-hexaazatriphenylene
Other name (1)：
  • 2,3,6,7,10,11-Hexakis(4-methoxystyryl)-1,4,5,8,9,12-hexaazatriphenylene
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