Chem
J-GLOBAL ID：201007048786293662   Nikkaji number：J2.834.197K

2-[4-[1,3,5,7-Tetramethyl-4,4-difluoro-4H-3a-azonia-4-bora(IV)-4a-aza-s-indacene-8-yl]phenylethynyl]-7-[4-[1,3,7-trimethyl-4,4-difluoro-5-[4-(dimethylamino)styryl]-4H-3a-azonia-4-bora(IV)-4a-aza-s-indacene-8-yl]phenylethynyl]-9,9-bis[2-(2-methoxyethoxy)ethyl]-9H-fluorene

2-[4-[1,3,5,7-テトラメチル-4,4-ジフルオロ-4H-3a-アゾニア-4-ボラ(IV)-4a-アザ-s-インダセン-8-イル]フェニルエチニル]-7-[4-[1,3,7-トリメチル-4,4-ジフルオロ-5-[4-(ジメチルアミノ)スチリル]-4H-3a-アゾニア-4-ボラ(IV)-4a-アザ-s-インダセン-8-イル]フェニルエチニル]-9,9-ビス[2-(2-メトキシエトキシ)エチル]-9H-フルオレン
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： C74H73B2F4N3[N+]2O4
Molecular formula furigana： C74-H73-B2-F4-N5-O4
Molecular weight： 1194.040
InChI： InChI=1S/C74H73B2F4N5O4/c1-48-42-52(5)82-70(48)68(71-49(2)43-53(6)83(71)75(82,77)78)60-25-16-55(17-26-60)12-14-58-23-32-64-65-33-24-59(47-67(65)74(66(64)46-58,34-36-88-40-38-86-10)35-37-89-41-39-87-11)15-13-56-18-27-61(28-19-56)69-72-50(3)44-54(7)84(72)76(79,80)85-63(45-51(4)73(69)85)31-22-57-20-29-62(30-21-57)81(8)9/h16-33,42-47H,34-41H2,1-11H3/q+2
InChI key： OCMYPPGGHFLKHO-UHFFFAOYSA-N
SMILES： COCCOCCC1(CCOCCOC)c2cc(ccc2c2ccc(cc12)C#Cc1ccc(cc1)C1=C2C(=CC(=[N+]2[B](F)(F)n2c(C=Cc3ccc(cc3)N(C)C)cc(C)c12)C)C)C#Cc1ccc(cc1)C1=C2C(=CC(=[N+]2[B](F)(F)n2c(C)cc(C)c12)C)C
Systematic name  (4)：
  • 2-[4-[1,3,5,7-テトラメチル-4,4-ジフルオロ-4H-3a-アゾニア-4-ボラ(IV)-4a-アザ-s-インダセン-8-イル]フェニルエチニル]-7-[4-[1,3,7-トリメチル-4,4-ジフルオロ-5-[4-(ジメチルアミノ)スチリル]-4H-3a-アゾニア-4-ボラ(IV)-4a-アザ-s-インダセン-8-イル]フェニルエチニル]-9,9-ビス[2-(2-メトキシエトキシ)エチル]-9H-フルオレン
  • N,N-ジメチル-4-[2-[8-[4-[9,9-ビス[2-(2-メトキシエトキシ)エチル]-7-[4-[4,4-ジフルオロ-1,3,5,7-テトラメチル-3a-アザ-4a-アゾニア-4-ボラ(IV)-s-インダセン-8-イル]フェニルエチニル]-9H-フルオレン-2-イルエチニル]フェニル]-4,4-ジフルオロ-1,5,7-トリメチル-3a-アザ-4a-アゾニア-4-ボラ(IV)-s-インダセン-3-イル]エテニル]アニリン
  • 8-[4-(2-{7-[2-(4-{2,2-ジフルオロ-4,6,10,12-テトラメチル-1λ5,3-ジアザ-2λ4-ボラトリシクロ[7.3.0.03,7]ドデカ-1(12),4,6,8,10-ペンタエン-1-イリウム-8-イル}フェニル)エチニル]-9,9-ビス[2-(2-メトキシエトキシ)エチル]-9H-フルオレン-2-イル}エチニル)フェニル]-4-{2-[4-(ジメチルアミノ)フェニル]エテニル}-2,2-ジフルオロ-6,10,12-トリメチル-1λ5,3-ジアザ-2λ4-ボラトリシクロ[7.3.0.03,7]ドデカ-1(12),4,6,8,10-ペンタエン-1-イリウム
  • 8-[4-(2-{7-[2-(4-{2,2-difluoro-4,6,10,12-tetramethyl-1λ5,3-diaza-2λ4-boratricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaen-1-ylium-8-yl}phenyl)ethynyl]-9,9-bis[2-(2-methoxyethoxy)ethyl]-9H-fluoren-2-yl}ethynyl)phenyl]-4-{2-[4-(dimethylamino)phenyl]ethenyl}-2,2-difluoro-6,10,12-trimethyl-1λ5,3-diaza-2λ4-boratricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaen-1-ylium
Other name (2)：
  • 2-[4-[1,3,5,7-Tetramethyl-4,4-difluoro-4H-3a-azonia-4-bora(IV)-4a-aza-s-indacene-8-yl]phenylethynyl]-7-[4-[1,3,7-trimethyl-4,4-difluoro-5-[4-(dimethylamino)styryl]-4H-3a-azonia-4-bora(IV)-4a-aza-s-indacene-8-yl]phenylethynyl]-9,9-bis[2-(2-methoxyethoxy)ethyl]-9H-fluorene
  • N,N-Dimethyl-4-[2-[8-[4-[9,9-bis[2-(2-methoxyethoxy)ethyl]-7-[4-[4,4-difluoro-1,3,5,7-tetramethyl-3a-aza-4a-azonia-4-bora(IV)-s-indacene-8-yl]phenylethynyl]-9H-fluorene-2-ylethynyl]phenyl]-4,4-difluoro-1,5,7-trimethyl-3a-aza-4a-azonia-4-bora(IV)-s-indacene-3-yl]ethenyl]aniline
Thsaurus map：
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