HRID810728

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID30165

Iodide ion

I-

HCID178445875

未命名化合物

结构：COc1ccc(Br)c2c1CN(C(=O)OC(C)(C)C)C(C(O)C(Cc1cc(F)cc(F)c1)NC(C)=O)C2

HCID178488285

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(CC(C)(C)C)c2c1CN(C(=O)OC(C)(C)C)C(C(O)C(Cc1cc(F)cc(F)c1)NC(C)=O)C2

HCID178490081

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d8ded3b7b5ed4c99b55a06377d70a4d5
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1]([CH3:2])(=[O:3])[NH:4][CH:5]([CH:6]([OH:7])[CH:8]1[N:9]([C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[CH2:10][c:11]2[c:12]([O:19][CH3:20])[cH:13][cH:14][c:15]([Br:18])[c:16]2[CH2:17]1)[CH2:28][c:29]1[cH:30][c:31]([F:36])[cH:32][c:33]([F:35])[cH:34]1.[CH2:41]([C:42]([CH3:43])([CH3:44])[CH3:45])[Zn+:46].[CH3:54][CH2:55][O:56][C:57](=[O:58])[CH3:59].[Cl-:47].[Cl:37][CH2:38][Cl:39].[I-:40].[NH4+:48].[O:49]1[CH2:50][CH2:51][CH2:52][CH2:53]1>>[C:1]([CH3:2])(=[O:3])[NH:4][CH:5]([CH:6]([OH:7])[CH:8]1[N:9]([C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[CH2:10][c:11]2[c:12]([O:19][CH3:20])[cH:13][cH:14][c:15]([CH2:41][C:42]([CH3:43])([CH3:44])[CH3:45])[c:16]2[CH2:17]1)[CH2:28][c:29]1[cH:30][c:31]([F:36])[cH:32][c:33]([F:35])[cH:34]1