HRID107904

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID3019290

1-(2,4-Dichlorophenyl)cyclopropanecarbonyl chloride

C10H7Cl3O

结构：CCNCc1cc(C(F)(F)F)ccc1-c1cc(CC(=O)OCC)ccc1OC

HCID66604101

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)Cc1ccc(OC)c(-c2ccc(C(F)(F)F)cc2CN(CC)C(=O)C2(c3ccc(Cl)cc3Cl)CC2)c1

HCID66607414

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e79a9446d24844fd8705adec4e81621b
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

[CH2:22]([CH3:23])[O:24][C:25]([CH2:26][c:27]1[cH:28][c:29](-[c:35]2[c:36]([CH2:45][NH:46][CH2:47][CH3:48])[cH:37][c:38]([C:41]([F:42])([F:43])[F:44])[cH:39][cH:40]2)[c:30]([O:33][CH3:34])[cH:31][cH:32]1)=[O:49].[CH3:15][CH2:16][N:17]([CH2:18][CH3:19])[CH2:20][CH3:21].[Cl:1][c:2]1[c:3]([C:9]2([C:12](=[O:13])[Cl:14])[CH2:10][CH2:11]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1.[Cl:51][CH2:52][Cl:53].[OH2:50]>>[Cl:1][c:2]1[c:3]([C:9]2([C:12](=[O:13])[N:46]([CH2:45][c:36]3[c:35](-[c:29]4[cH:28][c:27]([CH2:26][C:25]([O:24][CH2:22][CH3:23])=[O:49])[cH:32][cH:31][c:30]4[O:33][CH3:34])[cH:40][cH:39][c:38]([C:41]([F:42])([F:43])[F:44])[cH:37]3)[CH2:47][CH3:48])[CH2:10][CH2:11]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1