HRID936393

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID313

Hydrochloric Acid

ClH

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID8857

Ethyl acetate

C4H8O2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID81531

Diisopropylethylamine

C8H19N

HCID4192171

tert-butyl 3-aminopropanoate

C7H15NO2

结构：COc1ccc2cc(-c3cc(-c4cc(Cl)cc(Cl)c4)nn3C(C)c3ccc(C(=O)O)cc3)ccc2c1

HCID76723915

未命名化合物

PRODUCTS

生成物

结构：COc1ccc2cc(-c3cc(-c4cc(Cl)cc(Cl)c4)nn3C(C)c3ccc(C(=O)NCCC(=O)OC(C)(C)C)cc3)ccc2c1

HCID178487387

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8dc583dcc44b459783746a12193ba216
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:38]([CH3:39])([CH3:40])([CH3:41])[O:42][C:43]([CH2:44][CH2:45][NH2:46])=[O:47].[CH2:57]([Cl:58])[CH2:59][Cl:60].[CH3:62][N:63]([c:64]1[cH:65][cH:66][n:67][cH:68][cH:69]1)[CH3:70].[CH3:74][CH2:75][O:76][C:77](=[O:78])[CH3:79].[CH:48]([N:49]([CH2:50][CH3:51])[CH:52]([CH3:53])[CH3:54])([CH3:55])[CH3:56].[Cl:1][c:2]1[cH:3][c:4](-[c:9]2[n:10][n:11]([CH:26]([CH3:27])[c:28]3[cH:29][cH:30][c:31]([C:32](=[O:33])[OH:34])[cH:35][cH:36]3)[c:12](-[c:14]3[cH:15][c:16]4[cH:17][cH:18][c:19]([O:24][CH3:25])[cH:20][c:21]4[cH:22][cH:23]3)[cH:13]2)[cH:5][c:6]([Cl:8])[cH:7]1.[Cl:71][CH2:72][Cl:73].[ClH:37].[ClH:61]>>[Cl:1][c:2]1[cH:3][c:4](-[c:9]2[n:10][n:11]([CH:26]([CH3:27])[c:28]3[cH:29][cH:30][c:31]([C:32](=[O:33])[NH:46][CH2:45][CH2:44][C:43]([O:42][C:38]([CH3:39])([CH3:40])[CH3:41])=[O:47])[cH:35][cH:36]3)[c:12](-[c:14]3[cH:15][c:16]4[cH:17][cH:18][c:19]([O:24][CH3:25])[cH:20][c:21]4[cH:22][cH:23]3)[cH:13]2)[cH:5][c:6]([Cl:8])[cH:7]1