Chem
J-GLOBAL ID：200907044715511107   Nikkaji number：J2.391.377A

5,10,15,20-Tetrakis(4-dodecylphenyl)-1,20-dioxo-15-hydroxy-1,4-epinitrilo-6,9:11,14:16,19-triepimino-2,5,7,9,11,13,16,18-icosaoctaene

5,10,15,20-テトラキス(4-ドデシルフェニル)-1,20-ジオキソ-15-ヒドロキシ-1,4-エピニトリロ-6,9:11,14:16,19-トリエピミノ-2,5,7,9,11,13,16,18-イコサオクタエン
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： C92H128N4O3
Molecular formula furigana： C92-H128-N4-O3
Molecular weight： 1338.061
InChI： InChI=1S/C92H128N4O3/c1-5-9-13-17-21-25-29-33-37-41-45-73-49-57-77(58-50-73)89(81-65-66-82(93-81)90(84-69-72-88(97)96-84)78-59-51-74(52-60-78)46-42-38-34-30-26-22-18-14-10-6-2)83-67-70-86(94-83)92(99,80-63-55-76(56-64-80)48-44-40-36-32-28-24-20-16-12-8-4)87-71-68-85(95-87)91(98)79-61-53-75(54-62-79)47-43-39-35-31-27-23-19-15-11-7-3/h49-72,93-95,99H,5-48H2,1-4H3
InChI key： AOGPJKXSKCNHOW-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCCc1ccc(cc1)C(=O)c1ccc([nH]1)C(O)(c1ccc([nH]1)C(=c1ccc(=C(C2=NC(=O)C=C2)c2ccc(CCCCCCCCCCCC)cc2)[nH]1)c1ccc(CCCCCCCCCCCC)cc1)c1ccc(CCCCCCCCCCCC)cc1
Systematic name  (4)：
  • 5-[4-ドデシル-α-[5-[4-ドデシル-α-[5-[4-ドデシル-α-ヒドロキシ-α-[5-(4-ドデシルベンゾイル)-1H-ピロール-2-イル]ベンジル]-1H-ピロール-2-イル]ベンジリデン]-1H-ピロール-2(5H)-イリデン]ベンジル]-2H-ピロール-2-オン
  • 5,10,15,20-テトラキス(4-ドデシルフェニル)-1,20-ジオキソ-15-ヒドロキシ-1,4-エピニトリロ-6,9:11,14:16,19-トリエピミノ-2,5,7,9,11,13,16,18-イコサオクタエン
  • 5-({5-[(5-{[5-(4-ドデシルベンゾイル)-1H-ピロール-2-イル](4-ドデシルフェニル)ヒドロキシメチル}-1H-ピロール-2-イル)(4-ドデシルフェニル)メチリデン]-2,5-ジヒドロ-1H-ピロール-2-イリデン}(4-ドデシルフェニル)メチル)-2H-ピロール-2-オン
  • 5-({5-[(5-{[5-(4-dodecylbenzoyl)-1H-pyrrol-2-yl](4-dodecylphenyl)hydroxymethyl}-1H-pyrrol-2-yl)(4-dodecylphenyl)methylidene]-2,5-dihydro-1H-pyrrol-2-ylidene}(4-dodecylphenyl)methyl)-2H-pyrrol-2-one
Other name (2)：
  • 5-[4-Dodecyl-α-[5-[4-dodecyl-α-[5-[4-dodecyl-α-hydroxy-α-[5-(4-dodecylbenzoyl)-1H-pyrrole-2-yl]benzyl]-1H-pyrrole-2-yl]benzylidene]-1H-pyrrole-2(5H)-ylidene]benzyl]-2H-pyrrole-2-one
  • 5,10,15,20-Tetrakis(4-dodecylphenyl)-1,20-dioxo-15-hydroxy-1,4-epinitrilo-6,9:11,14:16,19-triepimino-2,5,7,9,11,13,16,18-icosaoctaene
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