HRID1131707

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID22057941

未命名化合物

HCID67133060

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(C(C)=O)N(C(=O)c1cc(N2CCOCC2)cc(C(F)(F)F)c1)C1CC1

HCID67133209

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ed80a467ca924b6b83d36e7a9257c65b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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