HRID935290

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(C)(C)OC(=O)NC(Cc1ccc(C(F)(F)F)cc1)C(=O)O

HCID2756832

2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-(trifluoromethyl)phenyl]propanoic Acid

C15H18F3NO4

结构：CC(C)(C)OC(=O)NC(Cc1ccc(Cl)cc1)C(=O)O

HCID4164897

N-(tert-Butoxycarbonyl)-4-chlorophenylalanine

C14H18ClNO4

结构：CC(C)(C)OC(=O)N1C(Cc2ccc(C(F)(F)F)cc2)COS1(=O)=O

HCID57950494

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1C(Cc2ccc(Cl)cc2)COS1(=O)=O

HCID57950604

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c446a49ed5ff470e8e7ff305b8b8ce08
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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