HRID2328926

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID10556

Propane, 1-iodo-2-methyl-

C4H9I

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

结构：CC(C)(C)OC(=O)NN1C(=O)Cc2ccccc2-c2ccccc21

HCID11493548

1,1-Dimethylethyl N-(6,7-dihydro-6-oxo-5H-dibenz[b,d]azepin-5-yl)carbamate

C19H20N2O3

PRODUCTS

生成物

结构：CC(C)CC1C(=O)N(NC(=O)OC(C)(C)C)c2ccccc2-c2ccccc21

HCID11653784

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7c71550abb2e48cb867f30ae7566e49a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[NH:8][N:9]1[c:10]2[c:11]([cH:21][cH:22][cH:23][cH:24]2)-[c:12]2[c:13]([cH:17][cH:18][cH:19][cH:20]2)[CH2:14][C:15]1=[O:16].[C:25](=[O:26])([O-:27])[O-:28].[Cl:41][CH2:42][Cl:43].[Cs+:29].[Cs+:30].[I:31][CH2:32][CH:33]([CH3:34])[CH3:35].[O:36]=[CH:37][N:38]([CH3:39])[CH3:40]>>[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[NH:8][N:9]1[c:10]2[c:11]([cH:21][cH:22][cH:23][cH:24]2)-[c:12]2[c:13]([cH:17][cH:18][cH:19][cH:20]2)[CH:14]([CH2:32][CH:33]([CH3:34])[CH3:35])[C:15]1=[O:16]