HRID1216292

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID21885

2-Dimethylaminopyridine

C7H10N2

HCID5200412

methyl 5-amino-2-chlorobenzoate

C8H8ClNO2

HCID69131874

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1cc(NC(=O)CCc2ccc(OCCCCCc3ccccc3)cc2OC)ccc1Cl

HCID58804649

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-58e22c9994ea4f36a76cb856d2c49313
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

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