HRID313126

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

HCID313

Hydrochloric Acid

ClH

2 次

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID11157

Benzylhydrazine

C7H10N2

结构：O=C1c2ccccc2-c2c1cccc2-c1nc2ccncc2[nH]1

HCID53393801

未命名化合物

PRODUCTS

生成物

结构：c1ccc(CNN=C2c3ccccc3-c3c2cccc3-c2nc3cnccc3[nH]2)cc1

HCID178420368

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ae84bb1666624108ac3df31be6767ac4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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