HRID314010

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID26255

Tetrafluoroborate

BF4-

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

未命名化合物

HCID1268219

4-[(tert-Butoxycarbonyl)amino]oxane-4-carboxylic acid

C11H19NO5

HCID44216431

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC1(C(=O)NC(Cc2ccc(I)cc2)C(N)=O)CCOCC1

HCID68431026

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bbffb2870531431e8586b483c1427b36
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[B-:40]([F:41])([F:42])([F:43])[F:44].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][C:9]1([C:15](=[O:16])[OH:17])[CH2:10][CH2:11][O:12][CH2:13][CH2:14]1.[CH2:31]([N:32]([CH:33]([CH3:34])[CH3:35])[CH:36]([CH3:37])[CH3:38])[CH3:39].[NH2:18][CH:19]([C:20](=[O:21])[NH2:22])[CH2:23][c:24]1[cH:25][cH:26][c:27]([I:30])[cH:28][cH:29]1.[O:62]=[CH:63][N:64]([CH3:65])[CH3:66].[n:45]1([O:46][C:47]([N:48]([CH3:49])[CH3:50])=[N+:51]([CH3:52])[CH3:53])[c:54]2[cH:55][cH:56][cH:57][cH:58][c:59]2[n:60][n:61]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][C:9]1([C:15](=[O:17])[NH:18][CH:19]([C:20](=[O:21])[NH2:22])[CH2:23][c:24]2[cH:25][cH:26][c:27]([I:30])[cH:28][cH:29]2)[CH2:10][CH2:11][O:12][CH2:13][CH2:14]1