Chem
J-GLOBAL ID：200907097799543242   Nikkaji number：J1.746.652F

N-[2-[5,15-Diheptyl-10-(1-methyl-1H-imidazol-2-yl)-21H,23H-porphyrin-20-yl]ethyl]-N′-[5-(methoxycarbonyl)pentyl]benzene-1,2:4,5-bis(dicarbimide)

N-[2-[5,15-ジヘプチル-10-(1-メチル-1H-イミダゾール-2-イル)-21H,23H-ポルフィリン-20-イル]エチル]-N′-[5-(メトキシカルボニル)ペンチル]ベンゼン-1,2:4,5-ビス(ジカルボイミド)
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： C57H64N8O6
Molecular formula furigana： C57-H64-N8-O6
Molecular weight： 957.189
InChI： InChI=1S/C57H64N8O6/c1-5-7-9-11-14-18-36-43-21-23-47(59-43)38(29-32-65-56(69)41-34-39-40(35-42(41)57(65)70)55(68)64(54(39)67)31-17-13-16-20-51(66)71-4)48-24-22-44(60-48)37(19-15-12-10-8-6-2)46-26-28-50(62-46)52(49-27-25-45(36)61-49)53-58-30-33-63(53)3/h21-28,30,33-35,59,62H,5-20,29,31-32H2,1-4H3/b43-36-,44-37-,45-36-,46-37-,47-38-,48-38-,52-49+,52-50+
InChI key： NWYGOPBQFRMGSB-BNFXHRRYSA-N
SMILES： CCCCCCC/C/1=c/2\cc/c(=C(/C3=N/C(=C(\c4ccc(/C(=C\5/C=CC1=N5)/c1nccn1C)[nH]4)/CCCCCCC)/C=C3)\CCn1c(=O)c3cc4c(cc3c1=O)c(=O)n(CCCCCC(=O)OC)c4=O)/[nH]2
Systematic name  (3)：
  • N-[2-[5,15-ジヘプチル-10-(1-メチル-1H-イミダゾール-2-イル)-21H,23H-ポルフィリン-20-イル]エチル]-N′-[5-(メトキシカルボニル)ペンチル]ベンゼン-1,2:4,5-ビス(ジカルボイミド)
  • 6-[1,3,5,7-テトラオキソ-1,2,3,5,6,7-ヘキサヒドロ-6-[2-[10,20-ジヘプチル-15-(1-メチル-1H-イミダゾール-2-イル)-21H,23H-ポルフィリン-5-イル]エチル]ベンゾ[1,2-c:4,5-c′]ジピロール-2-イル]ヘキサン酸メチル
  • 5-[2-[1,3,5,7-テトラオキソ-6-(6-オキソ-6-メトキシヘキシル)-2,6-ジヒドロベンゾ[1,2-c:4,5-c′]ジピロール-2-イル]エチル]-10,20-ジヘプチル-15-(1-メチル-2-イミダゾリル)-21H,23H-ポルフィリン
Other name (3)：
  • N-[2-[5,15-Diheptyl-10-(1-methyl-1H-imidazol-2-yl)-21H,23H-porphyrin-20-yl]ethyl]-N′-[5-(methoxycarbonyl)pentyl]benzene-1,2:4,5-bis(dicarbimide)
  • 6-[1,3,5,7-Tetraoxo-1,2,3,5,6,7-hexahydro-6-[2-[10,20-diheptyl-15-(1-methyl-1H-imidazol-2-yl)-21H,23H-porphyrin-5-yl]ethyl]benzo[1,2-c:4,5-c′]dipyrrol-2-yl]hexanoic acid methyl ester
  • 5-[2-[1,3,5,7-Tetraoxo-6-(6-oxo-6-methoxyhexyl)-2,6-dihydrobenzo[1,2-c:4,5-c′]dipyrrole-2-yl]ethyl]-10,20-diheptyl-15-(1-methyl-2-imidazolyl)-21H,23H-porphyrin
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