HRID663610

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID6108

4-Nitrobenzoic acid

C7H5NO4

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID14039

Monoacetyl hydrazine

C2H6N2O

HCID15908

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

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

PRODUCTS

生成物

HCID3332418

Benzoic acid, p-nitro-, acetylhydrazide

C9H9N3O4

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cc055df6c8f0403e97163e27826016e9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:44]([CH3:45])(=[O:46])[NH:47][NH2:48].[CH3:32][CH2:33][N:34]=[C:35]=[N:36][CH2:37][CH2:38][CH2:39][N:40]([CH3:41])[CH3:42].[CH:11]([N:12]([CH2:13][CH3:14])[CH:15]([CH3:16])[CH3:17])([CH3:18])[CH3:19].[ClH:43].[N+:20](=[O:21])([O-:22])[c:23]1[cH:24][cH:25][c:26]([C:27](=[O:28])[OH:29])[cH:30][cH:31]1.[O:49]=[CH:50][N:51]([CH3:52])[CH3:53].[OH2:54].[OH:1][n:2]1[c:3]2[c:4]([cH:5][cH:6][cH:7][cH:8]2)[n:9][n:10]1>>[N+:20](=[O:21])([O-:22])[c:23]1[cH:24][cH:25][c:26]([C:27](=[O:29])[NH:48][NH:47][C:44]([CH3:45])=[O:46])[cH:30][cH:31]1