HRID2344854

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID813

Potassium cation

K+

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID77568

Benzene, 1-(bromomethyl)-3-nitro-

C7H6BrNO2

HCID319508

Ethyl N-(diphenylmethylidene)glycinate

C17H17NO2

HCID4574913

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(Cc1cccc([N+](=O)[O-])c1)N=C(c1ccccc1)c1ccccc1

HCID86228801

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-74e97dced2fe49609c41565979b0ceb1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[Br:27][CH2:28][c:29]1[cH:30][c:31]([N+:35](=[O:36])[O-:37])[cH:32][cH:33][cH:34]1.[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][N:6]=[C:7]([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)=[O:20].[CH3:21][C:22]([CH3:23])([O-:24])[CH3:25].[Cl-:38].[K+:26].[NH4+:39].[O:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1.[OH2:45]>>[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([N:6]=[C:7]([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[CH2:28][c:29]1[cH:30][c:31]([N+:35](=[O:36])[O-:37])[cH:32][cH:33][cH:34]1)=[O:20]