HRID2325274

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID240

Benzaldehyde

C7H6O

HCID313

Hydrochloric Acid

ClH

HCID813

Potassium cation

K+

2 次

HCID6228

Dimethylformamide

C3H7NO

HCID19660

Carbonate Ion

CO3-2

HCID23393

2-(Chloromethyl)pyridine

C6H6ClN

HCID28557

18-Crown-6

C12H24O6

HCID76549797

未命名化合物

PRODUCTS

产物

HCID77596580

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-2df4b9ef1d5a404e809afd4bcbbae0b7
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

[C:33](=[O:34])([O-:35])[O-:36].[CH2:48]1[O:49][CH2:50][CH2:51][O:52][CH2:53][CH2:54][O:55][CH2:56][CH2:57][O:58][CH2:59][CH2:60][O:61][CH2:62][CH2:63][O:64][CH2:65]1.[CH:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)=[O:8].[ClH:39].[K+:37].[K+:38].[NH2:9][CH2:10][CH:11]([O:12][c:13]1[c:14]2[c:15]([NH:23][c:24]3[cH:25][c:26]([Cl:31])[c:27]([OH:30])[cH:28][cH:29]3)[n:16][cH:17][n:18][c:19]2[cH:20][cH:21][cH:22]1)[CH3:32].[O:66]=[CH:67][N:68]([CH3:69])[CH3:70].[c:40]1([CH2:46][Cl:47])[cH:41][cH:42][cH:43][cH:44][n:45]1>>[NH2:9][CH2:10][CH:11]([O:12][c:13]1[c:14]2[c:15]([NH:23][c:24]3[cH:25][c:26]([Cl:31])[c:27]([O:30][CH2:46][c:40]4[cH:41][cH:42][cH:43][cH:44][n:45]4)[cH:28][cH:29]3)[n:16][cH:17][n:18][c:19]2[cH:20][cH:21][cH:22]1)[CH3:32]