HRID2325941

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID84431

5,6-Dimethoxyindole

C10H11NO2

HCID170432

1H-Indole, 1-ethyl-2-methyl-

C11H13N

结构：CCn1c(C)c(C2=CC(c3c(C)n(CC)c4ccccc34)C(=O)O2)c2ccccc21

HCID20442724

3,5-Bis(1-ethyl-2-methyl-1H-indol-3-yl)furan-2(3H)-one

C26H26N2O2

结构：O=C1OC(c2cn(Cc3ccccc3)c3cc(F)ccc23)=CC1c1cn(Cc2ccccc2)c2cc(F)ccc12

HCID20442790

未命名化合物

PRODUCTS

生成物

结构：COc1cc2[nH]cc(C3(c4cn(Cc5ccccc5)c5cc(F)ccc45)C=C(c4cn(Cc5ccccc5)c5cc(F)ccc45)C(=O)O3)c2cc1OC

HCID20442760

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-06d4ee88171a46dfa9b1423e78d16de2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH2:41]([n:42]1[c:43]2[c:44]([cH:45][cH:46][cH:47][cH:48]2)[c:49]([CH:50]2[CH:51]=[C:52]([c:53]3[c:54]4[c:55]([cH:56][cH:57][cH:58][cH:59]4)[n:60]([CH2:61][CH3:62])[c:63]3[CH3:64])[O:65][C:66]2=[O:67])[c:68]1[CH3:69])[CH3:70].[CH2:84]([n:85]1[c:86]2[c:87]([cH:88][cH:89][cH:90][cH:91]2)[cH:92][c:93]1[CH3:94])[CH3:95].[CH3:71][O:72][c:73]1[cH:74][c:75]2[cH:76][cH:77][nH:78][c:79]2[cH:80][c:81]1[O:82][CH3:83].[F:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([CH:18]3[C:19](=[O:40])[O:20][C:21]([c:23]4[cH:24][n:25]([CH2:33][c:34]5[cH:35][cH:36][cH:37][cH:38][cH:39]5)[c:26]5[cH:27][c:28]([F:32])[cH:29][cH:30][c:31]45)=[CH:22]3)[cH:7][n:8]([CH2:11][c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)[c:9]2[cH:10]1>>[F:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([C:18]3=[CH:22][C:21]([c:23]4[cH:24][n:25]([CH2:33][c:34]5[cH:35][cH:36][cH:37][cH:38][cH:39]5)[c:26]5[cH:27][c:28]([F:32])[cH:29][cH:30][c:31]45)([c:76]4[c:75]5[cH:74][c:73]([O:72][CH3:71])[c:81]([O:82][CH3:83])[cH:80][c:79]5[nH:78][cH:77]4)[O:20][C:19]3=[O:40])[cH:7][n:8]([CH2:11][c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)[c:9]2[cH:10]1