HRID308190

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID313534

2-Bromo-4-nitrobenzoic acid

C7H4BrNO4

HCID10923240

未命名化合物

PRODUCTS

生成物

结构：CN(C)CCN(C(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccnc2cc3c(cc12)OCO3

HCID11730633

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1af963bdb6db47f9b6d8f2b03d31fd42
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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