HRID833347

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID996

Phenol

C6H6O

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID119047

Phenoxide

C6H5O-

HCID166653

Hydride

H-

结构：Cc1nc(Cl)c([N+](=O)[O-])c(NCCOCCNC(=O)OC(C)(C)C)c1C

HCID21913714

未命名化合物

PRODUCTS

生成物

结构：Cc1nc(Oc2ccccc2)c([N+](=O)[O-])c(NCCOCCNC(=O)OC(C)(C)C)c1C

HCID21913948

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6f7bb8ed39e04d8f9a0286ec194b0b4d
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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