HRID2337084

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID7918

Acetic anhydride

C4H6O3

HCID8471

Triethylamine

C6H15N

HCID600916

Ethyl 2,3,4,5-tetrafluorobenzoylacetate

C11H8F4O3

HCID21624254

(1-Aminocyclobutyl)methanol

C5H11NO

PRODUCTS

生成物

结构：CCOC(=O)C(=CNC1(CO)CCC1)C(=O)c1cc(F)c(F)c(F)c1F

HCID178471964

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b3979ef424a646ed9639663ed6bbf62e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH3:19][C:20]([O:21][C:22]([CH3:23])=[O:24])=[O:25].[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[CH3:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[NH2:26][C:27]1([CH2:31][OH:32])[CH2:28][CH2:29][CH2:30]1.[O:1]=[C:2]([CH2:3][C:4](=[O:5])[O:6][CH2:7][CH3:8])[c:9]1[c:10]([F:18])[c:11]([F:17])[c:12]([F:16])[c:13]([F:15])[cH:14]1>>[O:1]=[C:2]([C:3]([C:4](=[O:5])[O:6][CH2:7][CH3:8])=[CH:19][NH:26][C:27]1([CH2:31][OH:32])[CH2:28][CH2:29][CH2:30]1)[c:9]1[c:10]([F:18])[c:11]([F:17])[c:12]([F:16])[c:13]([F:15])[cH:14]1