HRID194513

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID81503

Bromomethylcyclopropane

C4H7Br

HCID282930

2-Chloro-4-iodoaniline

C6H5ClIN

结构：CC(C)(C)OC(=O)NC(C(=O)O)c1ccc(OCCOC2CCCCO2)cc1

HCID68617727

未命名化合物

结构：CC(C)(C)OC(=O)NC(C(=O)O)c1ccc(OCC2CC2)cc1

HCID68618841

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OCCOc1ccc(C(NC(=O)OC(C)(C)C)C(=O)O)cc1

HCID66815166

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c734a8002efb40288af87f83d53ec1d0
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

[C:10]([CH3:11])([CH3:12])([CH3:13])[O:14][C:15](=[O:16])[NH:17][CH:18]([C:19](=[O:20])[OH:21])[c:22]1[cH:23][cH:24][c:25]([O:28][CH2:29][CH:30]2[CH2:31][CH2:32]2)[cH:26][cH:27]1.[C:33]([CH3:34])([CH3:35])([CH3:36])[O:37][C:38]([NH:39][CH:40]([c:41]1[cH:42][cH:43][c:44]([O:45][CH2:46][CH2:47][O:48][CH:49]2[CH2:50][CH2:51][CH2:52][CH2:53][O:54]2)[cH:55][cH:56]1)[C:57]([OH:58])=[O:59])=[O:60].[CH:61]1([CH2:62][Br:63])[CH2:64][CH2:65]1.[Cl:1][c:2]1[cH:3][c:4]([I:5])[cH:6][cH:7][c:8]1[NH2:9]>>[C:10]([CH3:11])([CH3:12])([CH3:13])[O:14][C:15](=[O:16])[NH:17][CH:18]([C:19](=[O:20])[OH:21])[c:22]1[cH:23][cH:24][c:25]([O:28][CH2:29][CH2:30][O:37][C:33]([CH3:34])([CH3:35])[CH3:36])[cH:26][cH:27]1