HRID172397

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID259

Bromide

Br-

HCID312

Chloride

Cl-

HCID813

Potassium cation

K+

HCID3283

Diethyl Ether

C4H10O

HCID74506

Triphenylmethylphosphonium

C19H18P+

HCID3280088

未命名化合物

结构：COCCCOc1ccccc1C(=O)NCC(CC(C=O)NC(=O)OC(C)(C)C)C(C)C

HCID91165337

未命名化合物

PRODUCTS

生成物

结构：C=CC(CC(CNC(=O)c1ccccc1OCCCOC)C(C)C)NC(=O)OC(C)(C)C

HCID91344097

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-765027f98c7b4ceca50f642f6dcb902a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[Br-:50].[CH3:1][Si:2]([N-:3][Si:4]([CH3:5])([CH3:6])[CH3:7])([CH3:8])[CH3:9].[CH3:45][CH2:46][O:47][CH2:48][CH3:49].[CH3:51][P+:52]([c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1)([c:59]1[cH:60][cH:61][cH:62][cH:63][cH:64]1)[c:65]1[cH:66][cH:67][cH:68][cH:69][cH:70]1.[CH:11](=[O:12])[CH:13]([CH2:14][CH:15]([CH:16]([CH3:17])[CH3:18])[CH2:19][NH:20][C:21]([c:22]1[c:23]([O:28][CH2:29][CH2:30][CH2:31][O:32][CH3:33])[cH:24][cH:25][cH:26][cH:27]1)=[O:34])[NH:35][C:36]([O:37][C:38]([CH3:39])([CH3:40])[CH3:41])=[O:42].[Cl-:43].[K+:10].[NH4+:44]>>[CH2:1]=[CH:11][CH:13]([CH2:14][CH:15]([CH:16]([CH3:17])[CH3:18])[CH2:19][NH:20][C:21]([c:22]1[c:23]([O:28][CH2:29][CH2:30][CH2:31][O:32][CH3:33])[cH:24][cH:25][cH:26][cH:27]1)=[O:34])[NH:35][C:36]([O:37][C:38]([CH3:39])([CH3:40])[CH3:41])=[O:42]