HRID2337551

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID7912

Diisopropylamine

C6H15N

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID277542

Cyclohexanone dimethylhydrazone

C8H16N2

HCID15380636

Methyl 4-(chlorocarbonyl)cyclohexane-1-carboxylate

C9H13ClO3

HCID178418339

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C1CCC(C(=O)C2CCCCC2=NN(C)C)CC1

HCID67463980

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-48f8dd8c914c46d08602c79a4d6eadbf
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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