HRID1536944

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6367

Acetyl chloride

C2H3ClO

HCID8857

Ethyl acetate

C4H8O2

HCID81531

Diisopropylethylamine

C8H19N

结构：CC1(COC2CN(C(=O)OC(C)(C)C)C(C(O)C(N)Cc3cccc(OCc4ccccc4)c3)CO2)CCCC1

HCID77515111

未命名化合物

PRODUCTS

生成物

结构：CC(=O)NC(Cc1cccc(OCc2ccccc2)c1)C(O)C1COC(OCC2(C)CCCC2)CN1C(=O)OC(C)(C)C

HCID77514559

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9bbd836a1fd14961a91679be6797deb6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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