HRID109611

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID813

Potassium cation

K+

HCID3283

Diethyl Ether

C4H10O

HCID8028

Tetrahydrofuran

C4H8O

HCID87885

Propanoic acid, 2,2-dimethyl-, chloromethyl ester

C6H11ClO2

HCID3280088

未命名化合物

HCID21260646

未命名化合物

PRODUCTS

生成物

结构：Cc1c(-c2cccnc2)n(COC(=O)C(C)(C)C)c2ccc(Cl)cc12

HCID58215599

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7e21f199ed734b3ca4e967498c028174
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

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