HRID140002

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID464

Hippuric acid

C9H9NO3

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID15908

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

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID18426145

未命名化合物

PRODUCTS

生成物

结构：O=C(CNC(=O)c1ccccc1)NCC1CCN(Cc2ccc(Cl)cc2)CC1

HCID18426192

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e97467f0dc82473893c1dda184512c05
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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