Chem
J-GLOBAL ID：200907000744468817   Nikkaji number：J1.714.411A

4-[15-[4-(Didodecylamino)phenylethynyl]-10,20-diphenyl-21H,23H-porphyrin-5-ylethynyl]benzonitrile

4-[15-[4-(ジドデシルアミノ)フェニルエチニル]-10,20-ジフェニル-21H,23H-ポルフィリン-5-イルエチニル]ベンゾニトリル
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： C73H78N6
Molecular formula furigana： C73-H78-N6
Molecular weight： 1039.469
InChI： InChI=1S/C73H78N6/c1-3-5-7-9-11-13-15-17-19-27-53-79(54-28-20-18-16-14-12-10-8-6-4-2)61-41-37-57(38-42-61)40-44-63-66-47-51-70(77-66)72(59-29-23-21-24-30-59)68-49-45-64(75-68)62(43-39-56-33-35-58(55-74)36-34-56)65-46-50-69(76-65)73(60-31-25-22-26-32-60)71-52-48-67(63)78-71/h21-26,29-38,41-42,45-52,75,78H,3-20,27-28,53-54H2,1-2H3/b64-62-,65-62-,66-63-,67-63-,72-68-,72-70-,73-69-,73-71-
InChI key： LTTKARBHVFFYPM-VQJTUHTQSA-N
SMILES： CCCCCCCCCCCCN(CCCCCCCCCCCC)c1ccc(cc1)C#C/C/1=c/2\cc/c(=C(/C3=N/C(=C(\c4ccc(/C(=C\5/C=CC1=N5)/c1ccccc1)[nH]4)/C#Cc1ccc(cc1)C#N)/C=C3)\c1ccccc1)/[nH]2
Systematic name  (3)：
  • 4-[15-[4-(ジドデシルアミノ)フェニルエチニル]-10,20-ジフェニル-21H,23H-ポルフィリン-5-イルエチニル]ベンゾニトリル
  • 4-[2-(12-{2-[4-(ジドデシルアミノ)フェニル]エチニル}-7,17-ジフェニル-21,22,23,24-テトラアザペンタシクロ[16.2.1.13,6.18,11.113,16]テトラコサ-1,3,5,7,9,11(23),12,14,16,18(21),19-ウンデカエン-2-イル)エチニル]ベンゾニトリル
  • 4-[2-(12-{2-[4-(didodecylamino)phenyl]ethynyl}-7,17-diphenyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl)ethynyl]benzonitrile
Other name (1)：
  • 4-[15-[4-(Didodecylamino)phenylethynyl]-10,20-diphenyl-21H,23H-porphyrin-5-ylethynyl]benzonitrile
Thsaurus map：
Thesaurus Map

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