HRID1553719

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID1049

Pyridine

C5H5N

HCID31275

1,4-Dioxane

C4H8O2

HCID240032

heptanohydrazide

C7H16N2O

结构：CCCCCCCCc1ccc2c(c1)Cc1cc(C(=O)Cl)ccc1-2

HCID19760665

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCCc1ccc2c(c1)Cc1cc(C(=O)NNC(=O)CCCCCC)ccc1-2

HCID19760658

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-97c9bcb3ca2441a180cabbcb13c2b63e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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