HRID695914

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID10635129

6-Chloro-2-Naphthylsulfonyl Chloride

C10H6Cl2O2S

HCID22727214

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NN1CCN(S(=O)(=O)c2ccc3cc(Cl)ccc3c2)CC1=O

HCID22727035

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1f51781d92a1456e85dcbe544a4cc007
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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