HRID2139965

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID962

Water

H2O

HCID1049

Pyridine

C5H5N

HCID1140

Toluene

C7H8

HCID2734926

N-methoxy-N-methylcarbamoyl chloride

C3H6ClNO2

HCID4989215

Pyridinium

C5H6N+

HCID22756001

未命名化合物

PRODUCTS

生成物

结构：CON(C)C(=O)Nc1ccc(OCCc2ccc(C(C)(C)C)cc2)cc1

HCID22756005

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-df060add66f64e21b0f235ce038b1b21
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH2:9][CH2:10][O:11][c:12]2[cH:13][cH:14][c:15]([NH2:16])[cH:17][cH:18]2)[cH:19][cH:20]1.[CH3:21][O:22][N:23]([C:24](=[O:25])[Cl:26])[CH3:27].[CH3:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1.[Cl-:34].[OH2:41].[cH:28]1[cH:29][cH:30][n:31][cH:32][cH:33]1.[nH+:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH2:9][CH2:10][O:11][c:12]2[cH:13][cH:14][c:15]([NH:16][C:24]([N:23]([O:22][CH3:21])[CH3:27])=[O:25])[cH:17][cH:18]2)[cH:19][cH:20]1