HRID1211074

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID6809

Phthalimide

C8H5NO2

HCID8471

Triethylamine

C6H15N

HCID16028

Tetrabutylammonium

C16H36N+

HCID31297

Methanesulfonyl chloride

CH3ClO2S

HCID5201202

tert-Butyl 2-(hydroxymethyl)morpholine-4-carboxylate

C10H19NO4

HCID5462222

Potassium

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCOC(CN2C(=O)c3ccccc3C2=O)C1

HCID58992660

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b50c0b975fc44930a624297e59266da2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[Br-:42].[C:28]1(=[O:38])[c:29]2[c:30]([cH:34][cH:35][cH:36][cH:37]2)[C:31](=[O:33])[NH:32]1.[CH3:16][CH2:17][N:18]([CH2:19][CH3:20])[CH2:21][CH3:22].[CH3:23][S:24](=[O:25])(=[O:26])[Cl:27].[CH3:43][CH2:44][CH2:45][CH2:46][N+:47]([CH2:48][CH2:49][CH2:50][CH3:51])([CH2:52][CH2:53][CH2:54][CH3:55])[CH2:56][CH2:57][CH2:58][CH3:59].[CH3:61][c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1.[K:39].[Na+:41].[OH-:40].[OH2:60].[OH:1][CH2:2][CH:3]1[O:4][CH2:5][CH2:6][N:7]([C:9](=[O:10])[O:11][C:12]([CH3:13])([CH3:14])[CH3:15])[CH2:8]1>>[CH2:2]([CH:3]1[O:4][CH2:5][CH2:6][N:7]([C:9](=[O:10])[O:11][C:12]([CH3:13])([CH3:14])[CH3:15])[CH2:8]1)[N:32]1[C:28](=[O:38])[c:29]2[c:30]([cH:34][cH:35][cH:36][cH:37]2)[C:31]1=[O:33]