HRID1229035

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

HCID8857

Ethyl acetate

C4H8O2

HCID12052

Silane, triethyl-

C6H16Si

HCID19660

Carbonate

CO3-2

结构：COC(=O)c1cccc2c1NC(c1cccc(C(=O)OCc3ccccc3)c1)C(C)(C)C2O

HCID67443442

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1cccc2c1NC(c1cccc(C(=O)OCc3ccccc3)c1)C(C)(C)C2

HCID67441263

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bb03ab3a0f43460c8d04b0e8badf5ee9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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