HRID815009

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID8857

Ethyl acetate

C4H8O2

HCID16028

Tetrabutylammonium

C16H36N+

HCID30165

Iodide ion

I-

HCID166653

Hydride

H-

HCID4067207

3-Methoxybenzyl bromide

C8H9BrO

结构：CCOC(=O)C(C)(Cc1ccc(OCCC2CNC(=O)N2C)cc1)Oc1ccccc1F

HCID68867329

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(C)(Cc1ccc(OCCC2CN(Cc3cccc(OC)c3)C(=O)N2C)cc1)Oc1ccccc1F

HCID10175101

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-eb21ef927ad44e19b77cae71e1a36227
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

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