HRID1238681

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6586

Methyl chlorocarbonate

C2H3ClO2

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

结构：CCCCCCC(C)(C)c1ccc(C2CC(O)CCN2)c(OCc2ccccc2)c1

HCID20274354

未命名化合物

PRODUCTS

生成物

结构：CCCCCCC(C)(C)c1ccc(C2CC(O)CCN2C(=O)OC)c(OCc2ccccc2)c1

HCID20274350

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5a9f70c2b6494dbe9bf23fe48c89ab1f
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

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([CH:24]2[NH:25][CH2:26][CH2:27][CH:28]([OH:30])[CH2:29]2)[cH:11][cH:12][c:13]([C:15]([CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH3:21])([CH3:22])[CH3:23])[cH:14]1.[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[Cl:38][C:39](=[O:40])[O:41][CH3:42].[O:43]1[CH2:44][CH2:45][CH2:46][CH2:47]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([CH:24]2[N:25]([C:39](=[O:40])[O:41][CH3:42])[CH2:26][CH2:27][CH:28]([OH:30])[CH2:29]2)[cH:11][cH:12][c:13]([C:15]([CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH3:21])([CH3:22])[CH3:23])[cH:14]1