Chem
J-GLOBAL ID：200907002915384296   Nikkaji number：J2.714.144G

21,24,29,32,37,40-Hexakis[4-(diphenylamino)phenyl]-1,2:3,4:7,8:9,10:13,14:15,16-hexa[1,3]butadienodiquinoxalino[2,3-a:2′,3′-c]phenazine

21,24,29,32,37,40-ヘキサキス[4-(ジフェニルアミノ)フェニル]-1,2:3,4:7,8:9,10:13,14:15,16-ヘキサ[1,3]ブタジエノジキノキサリノ[2,3-a:2′,3′-c]フェナジン
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： C156H102N12
Molecular formula furigana： C156-H102-N12
Molecular weight： 2144.616
InChI： InChI=1S/C156H102N12/c1-13-37-115(38-14-1)163(116-39-15-2-16-40-116)127-79-61-103(62-80-127)109-73-91-133-139(97-109)140-98-110(104-63-81-128(82-64-104)164(117-41-17-3-18-42-117)118-43-19-4-20-44-118)74-92-134(140)146-145(133)157-151-152(158-146)154-156(162-150-138-96-78-114(108-71-89-132(90-72-108)168(125-57-33-11-34-58-125)126-59-35-12-36-60-126)102-144(138)143-101-113(77-95-137(143)149(150)160-154)107-69-87-131(88-70-107)167(123-53-29-9-30-54-123)124-55-31-10-32-56-124)155-153(151)159-147-135-93-75-111(105-65-83-129(84-66-105)165(119-45-21-5-22-46-119)120-47-23-6-24-48-120)99-141(135)142-100-112(76-94-136(142)148(147)161-155)106-67-85-130(86-68-106)166(121-49-25-7-26-50-121)122-51-27-8-28-52-122/h1-102H
InChI key： XFIMPIJYSNFMSR-UHFFFAOYSA-N
SMILES： c1ccc(cc1)N(c1ccccc1)c1ccc(cc1)c1ccc2c(c1)c1cc(ccc1c1nc3c(nc21)c1nc2c4ccc(cc4c4cc(ccc4c2nc1c1nc2c4ccc(cc4c4cc(ccc4c2nc31)c1ccc(cc1)N(c1ccccc1)c1ccccc1)c1ccc(cc1)N(c1ccccc1)c1ccccc1)c1ccc(cc1)N(c1ccccc1)c1ccccc1)c1ccc(cc1)N(c1ccccc1)c1ccccc1)c1ccc(cc1)N(c1ccccc1)c1ccccc1
Systematic name  (4)：
  • 2,3-[5,5′-ビス[4-(ジフェニルアミノ)フェニル]ビフェニル-2,2′-ジイル]-6,7-[5,5′-ビス[4-(ジフェニルアミノ)フェニル]ビフェニル-2,2′-ジイル]-10,11-[5,5′-ビス[4-(ジフェニルアミノ)フェニル]ビフェニル-2,2′-ジイル]-1,4,5,8,9,12-ヘキサアザトリフェニレン
  • 21,24,29,32,37,40-ヘキサキス[4-(ジフェニルアミノ)フェニル]-1,2:3,4:7,8:9,10:13,14:15,16-ヘキサ[1,3]ブタジエノジキノキサリノ[2,3-a:2′,3′-c]フェナジン
  • 4-{13,26,31,44,49-ペンタキス[4-(ジフェニルアミノ)フェニル]-3,18,21,36,39,54-ヘキサアザトリデカシクロ[36.16.0.02,19.04,17.05,10.011,16.020,37.022,35.023,28.029,34.040,53.041,46.047,52]テトラペンタコンタ-1(38),2(19),3,5,7,9,11,13,15,17,20(37),21,23,25,27,29,31,33,35,39,41,43,45,47,49,51,53-ヘプタコサエン-8-イル}-N,N-ジフェニルアニリン
  • 4-{13,26,31,44,49-pentakis[4-(diphenylamino)phenyl]-3,18,21,36,39,54-hexaazatridecacyclo[36.16.0.02,19.04,17.05,10.011,16.020,37.022,35.023,28.029,34.040,53.041,46.047,52]tetrapentaconta-1(38),2(19),3,5,7,9,11,13,15,17,20(37),21,23,25,27,29,31,33,35,39,41,43,45,47,49,51,53-heptacosaen-8-yl}-N,N-diphenylaniline
Other name (2)：
  • 2,3-[5,5′-Bis[4-(diphenylamino)phenyl]biphenyl-2,2′-diyl]-6,7-[5,5′-bis[4-(diphenylamino)phenyl]biphenyl-2,2′-diyl]-10,11-[5,5′-bis[4-(diphenylamino)phenyl]biphenyl-2,2′-diyl]-1,4,5,8,9,12-hexaazatriphenylene
  • 21,24,29,32,37,40-Hexakis[4-(diphenylamino)phenyl]-1,2:3,4:7,8:9,10:13,14:15,16-hexa[1,3]butadienodiquinoxalino[2,3-a:2′,3′-c]phenazine
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