HRID113177

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6342

Acetonitrile

C2H3N

HCID8857

Ethyl acetate

C4H8O2

HCID10740

Benzene, 1,1'-ethenylidenebis-

C14H12

HCID120273

N-Iodosuccinimide

C4H4INO2

HCID4571337

boc-Serino(bzl)

C15H23NO4

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC(COCc1ccccc1)COC(CI)(c1ccccc1)c1ccccc1

HCID77514010

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6bca8e6a195d43b1a68a7a64968c3d1c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH2:9][O:10][CH2:11][c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)[CH2:18][OH:19])=[O:20].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[CH3:49][C:50]#[N:51].[I:35][N:36]1[C:37](=[O:38])[CH2:39][CH2:40][C:41]1=[O:42].[c:21]1([C:27](=[CH2:28])[c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[cH:22][cH:23][cH:24][cH:25][cH:26]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH2:9][O:10][CH2:11][c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)[CH2:18][O:19][C:27]([c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)([CH2:28][I:35])[c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1)=[O:20]