HRID125540

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID89952

3-Indoleglyoxylyl chloride

C10H6ClNO2

结构：COc1ccccc1C1(O)CCC(c2ccccc2)(c2ccccc2)C2CNCC21

HCID19376827

未命名化合物

PRODUCTS

生成物

结构：COc1ccccc1C1(O)CCC(c2ccccc2)(c2ccccc2)C2CN(C(=O)C(=O)c3c[nH]c4ccccc34)CC21

HCID178489429

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-63c10f6ca57544b6aa8981d5a1349b34
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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