HRID820182

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID767

Carbonic Acid

CH2O3

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

3 次

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

HCID19660

Carbonate

CO3-2

结构：CNC(=O)C(Cc1ccccc1F)N(C)C(=O)C(Cc1ccc2ccccc2c1)N(C)C(=O)C=CCC(C)(C)NC(=O)OC(C)(C)C

HCID53791932

未命名化合物

PRODUCTS

生成物

结构：CNC(=O)C(Cc1ccccc1F)N(C)C(=O)C(Cc1ccc2ccccc2c1)N(C)C(=O)C=CCC(C)(C)N

HCID53759916

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-76c6efc3c1734dd984298118bb0d1e21
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]([O:2][C:3](=[O:4])[NH:7][C:8]([CH2:9][CH:10]=[CH:11][C:12]([N:13]([CH3:14])[CH:15]([CH2:16][c:17]1[cH:18][c:19]2[cH:20][cH:21][cH:22][cH:23][c:24]2[cH:25][cH:26]1)[C:27]([N:28]([CH3:29])[CH:30]([CH2:31][c:32]1[c:33]([F:38])[cH:34][cH:35][cH:36][cH:37]1)[C:39]([NH:40][CH3:41])=[O:42])=[O:43])=[O:44])([CH3:45])[CH3:46])([CH3:5])([CH3:6])[CH3:47].[C:55](=[O:56])([O-:57])[O-:58].[C:60](=[O:61])([OH:62])[OH:63].[C:65](=[O:66])([O-:67])[OH:68].[CH2:70]([Cl:71])[Cl:72].[F:48][C:49]([F:50])([F:51])[C:52]([OH:53])=[O:54].[Na+:59].[Na+:64].[Na+:69]>>[NH2:7][C:8]([CH2:9][CH:10]=[CH:11][C:12]([N:13]([CH3:14])[CH:15]([CH2:16][c:17]1[cH:18][c:19]2[cH:20][cH:21][cH:22][cH:23][c:24]2[cH:25][cH:26]1)[C:27]([N:28]([CH3:29])[CH:30]([CH2:31][c:32]1[c:33]([F:38])[cH:34][cH:35][cH:36][cH:37]1)[C:39]([NH:40][CH3:41])=[O:42])=[O:43])=[O:44])([CH3:45])[CH3:46]