HRID100604

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID6344

Dichloromethane

CH2Cl2

HCID6397

Chlorotrimethylsilane

C3H9ClSi

HCID8471

Triethylamine

C6H15N

HCID12373909

2-Hydroxy-5-nitrobenzoyl chloride

C7H4ClNO4

HCID13442375

4-(2-Aminobenzamido)butanoic acid

C11H14N2O3

PRODUCTS

生成物

结构：O=C(O)CCCNC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1O

HCID23118551

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2d16642bfb6d44348c7dcc620f6f7143
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

[CH2:45]([Cl:46])[Cl:47].[CH3:17][Si:18]([Cl:19])([CH3:20])[CH3:21].[CH3:22][CH2:23][N:24]([CH2:25][CH3:26])[CH2:27][CH3:28].[ClH:44].[NH2:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][CH2:7][CH2:8][CH2:9][C:10](=[O:11])[OH:12])[cH:13][cH:14][cH:15][cH:16]1.[Na+:43].[OH-:42].[OH:29][c:30]1[c:31]([C:32](=[O:33])[Cl:34])[cH:35][c:36]([N+:39](=[O:40])[O-:41])[cH:37][cH:38]1>>[NH:1]([c:2]1[c:3]([C:4](=[O:5])[NH:6][CH2:7][CH2:8][CH2:9][C:10](=[O:11])[OH:12])[cH:13][cH:14][cH:15][cH:16]1)[C:32]([c:31]1[c:30]([OH:29])[cH:38][cH:37][c:36]([N+:39](=[O:40])[O-:41])[cH:35]1)=[O:33]