HRID181249

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID81531

Diisopropylethylamine

C8H19N

HCID3826287

benzyl 2,5-dioxopyrrolidine-1-carboxylate

C12H11NO4

HCID69215940

未命名化合物

PRODUCTS

生成物

结构：O=C(NC(Cc1cc(I)ccc1OCc1ccccc1)C(=O)O)OCc1ccccc1

HCID66879740

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-51869ae3797c42cb9298992d66e3df57
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH2:32]([c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1)[O:39][C:40](=[O:41])[N:42]1[C:43](=[O:44])[CH2:45][CH2:46][C:47]1=[O:48].[CH:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])([CH3:8])[CH3:9].[ClH:10].[NH2:11][CH:12]([C:13](=[O:14])[OH:15])[CH2:16][c:17]1[c:18]([O:24][CH2:25][c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[cH:19][cH:20][c:21]([I:23])[cH:22]1.[O:49]=[CH:50][N:51]([CH3:52])[CH3:53]>>[NH:11]([CH:12]([C:13](=[O:14])[OH:15])[CH2:16][c:17]1[c:18]([O:24][CH2:25][c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[cH:19][cH:20][c:21]([I:23])[cH:22]1)[C:40]([O:39][CH2:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1)=[O:41]