HRID187747

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID7748

Ethyl bromoacetate

C4H7BrO2

HCID8028

Tetrahydrofuran

C4H8O

HCID19660

Carbonate

CO3-2

结构：CCC(NC(=O)c1c(O)c(-c2ccccc2)nc2ccccc12)c1ccccc1

HCID133090

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)COc1c(-c2ccccc2)nc2ccccc2c1C(=O)NC(CC)c1ccccc1

HCID21710477

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-28adc64ab8dc4bfcb78158d577231ad7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[Br:36][CH2:37][C:38](=[O:39])[O:40][CH2:41][CH3:42].[CH2:1]([CH3:2])[CH:3]([c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1)[NH:10][C:11](=[O:12])[c:13]1[c:14]([OH:29])[c:15](-[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[n:16][c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]12.[CH2:43]1[O:44][CH2:45][CH2:46][CH2:47]1.[K+:30].[K+:31].[O-:32][C:33]([O-:34])=[O:35]>>[CH2:1]([CH3:2])[CH:3]([c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1)[NH:10][C:11](=[O:12])[c:13]1[c:14]([O:29][CH2:37][C:38](=[O:39])[O:40][CH2:41][CH3:42])[c:15](-[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[n:16][c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]12