HRID168405

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID151928

5-Methyl-2-(propan-2-yl)cyclohexyl carbonochloridate

C11H19ClO2

HCID16640696

未命名化合物

PRODUCTS

生成物

结构：CC1CCC(C(C)C)C(OC(=O)N2CCc3ccccc3C2c2ccc(C(F)(F)F)cc2)C1

HCID178424975

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-066731fde1b14eb8b3d76a5369bda88a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:21]([O:22][CH:23]1[CH:24]([CH:30]([CH3:31])[CH3:32])[CH2:25][CH2:26][CH:27]([CH3:29])[CH2:28]1)(=[O:33])[Cl:34].[Cl:36][CH2:37][Cl:38].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH:9]2[NH:10][CH2:11][CH2:12][c:13]3[cH:14][cH:15][cH:16][cH:17][c:18]32)[cH:7][cH:8]1)([F:19])[F:20].[OH2:35]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH:9]2[N:10]([C:21]([O:22][CH:23]3[CH:24]([CH:30]([CH3:31])[CH3:32])[CH2:25][CH2:26][CH:27]([CH3:29])[CH2:28]3)=[O:33])[CH2:11][CH2:12][c:13]3[cH:14][cH:15][cH:16][cH:17][c:18]32)[cH:7][cH:8]1)([F:19])[F:20]