Chem
J-GLOBAL ID:200907050698116096   Nikkaji number:J2.196.466B

N,N′,N′′,N′′′-Tetrakis(4-cyanophenyl)-25,26,27,28-tetrabutoxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-5,11,17,23-tetrakis[(E)-acrylamide]

N,N′,N′′,N′′′-テトラキス(4-シアノフェニル)-25,26,27,28-テトラブトキシペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-5,11,17,23-テトラキス[(E)-アクリルアミド]
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: C84H80N8O8
Molecular formula furigana: C84-H80-N8-O8
Molecular weight: 1329.612
InChI: InChI=1S/C84H80N8O8/c1-5-9-37-97-81-65-41-61(21-33-77(93)89-73-25-13-57(53-85)14-26-73)42-66(81)50-68-44-63(23-35-79(95)91-75-29-17-59(55-87)18-30-75)46-70(83(68)99-39-11-7-3)52-72-48-64(24-36-80(96)92-76-31-19-60(56-88)20-32-76)47-71(84(72)100-40-12-8-4)51-69-45-62(43-67(49-65)82(69)98-38-10-6-2)22-34-78(94)90-74-27-15-58(54-86)16-28-74/h13-36,41-48H,5-12,37-40,49-52H2,1-4H3,(H,89,93)(H,90,94)(H,91,95)(H,92,96)/b33-21-,34-22+,35-23+,36-24+
InChI key: DEBDNQYTKHKCGY-IRQRSEBDSA-N
SMILES: CCCCOc1c2Cc3cc(/C=C/C(=O)Nc4ccc(cc4)C#N)cc(Cc4cc(/C=C/C(=O)Nc5ccc(cc5)C#N)cc(Cc5cc(/C=C\C(=O)Nc6ccc(cc6)C#N)cc(Cc1cc(/C=C/C(=O)Nc1ccc(cc1)C#N)c2)c5OCCCC)c4OCCCC)c3OCCCC
Systematic name  (3):
  • N,N′,N′′,N′′′-テトラキス(4-シアノフェニル)-25,26,27,28-テトラブトキシペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-5,11,17,23-テトラキス[(E)-アクリルアミド]
  • (2E)-N-(4-シアノフェニル)-3-{25,26,27,28-テトラブトキシ-11,23-ビス[(1E)-2-[(4-シアノフェニル)カルバモイル]エタ-1-エン-1-イル]-17-[(1Z)-2-[(4-シアノフェニル)カルバモイル]エタ-1-エン-1-イル]ペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-5-イル}プロパ-2-エンアミド
  • (2E)-N-(4-cyanophenyl)-3-{25,26,27,28-tetrabutoxy-11,23-bis[(1E)-2-[(4-cyanophenyl)carbamoyl]eth-1-en-1-yl]-17-[(1Z)-2-[(4-cyanophenyl)carbamoyl]eth-1-en-1-yl]pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaen-5-yl}prop-2-enamide
Other name (1):
  • N,N′,N′′,N′′′-Tetrakis(4-cyanophenyl)-25,26,27,28-tetrabutoxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-5,11,17,23-tetrakis[(E)-acrylamide]
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