HRID1200337

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID21885

2-Dimethylaminopyridine

C7H10N2

HCID65578

Ethanedioyl dichloride

C2Cl2O2

结构：O=C(O)c1cc(-c2ccccc2)c(=O)n2c1-c1cc(Cl)ccc1CC2

HCID14666744

未命名化合物

HCID21333172

3-Ethoxypyrrolidine

C6H13NO

2 次

PRODUCTS

生成物

结构：CCOC1CCN(C(=O)c2cc(-c3ccccc3)c(=O)n3c2-c2cc(Cl)ccc2CC3)C1

HCID14770132

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4962f2f7b6fb4d4c94c37f6c5a9c707e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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