HRID201377

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID91933

4-Chloro-3-nitrobenzenemethanol

C7H6ClNO3

HCID220568

Diethyl azodicarboxylate

C6H10N2O4

HCID10773885

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)CN1CC(=O)N(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1=O

HCID10665913

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1c6877a6cdc14b939c3fb33f510ca2d6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[N+:13](=[O:14])([O-:15])[c:16]1[cH:17][c:18]([CH2:19][OH:20])[cH:21][cH:22][c:23]1[Cl:24].[O:1]=[C:2]([O:3][CH2:4][CH3:5])[N:6]=[N:7][C:8]([O:9][CH2:10][CH3:11])=[O:12].[O:25]=[C:26]1[N:27]([CH2:32][C:33](=[O:34])[O:35][CH2:36][CH3:37])[CH2:28][C:29](=[O:31])[NH:30]1.[O:57]1[CH2:58][CH2:59][CH2:60][CH2:61]1.[OH2:62].[c:38]1([P:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[cH:52][cH:53][cH:54][cH:55][cH:56]1>>[N+:13](=[O:14])([O-:15])[c:16]1[cH:17][c:18]([CH2:19][N:30]2[C:26](=[O:25])[N:27]([CH2:32][C:33](=[O:34])[O:35][CH2:36][CH3:37])[CH2:28][C:29]2=[O:31])[cH:21][cH:22][c:23]1[Cl:24]