HRID287986

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID8028

Tetrahydrofuran

C4H8O

HCID75676

Diethyl (cyanomethyl)phosphonate

C6H12NO3P

结构：CCC(=CCc1c(OC)c(C)c2c(c1OCC[Si](C)(C)C)C(=O)OC2)CBr

HCID67009884

未命名化合物

PRODUCTS

生成物

结构：CCOP(=O)(OCC)C(C#N)CC(=CCc1c(OC)c(C)c2c(c1OCC[Si](C)(C)C)C(=O)OC2)CC

HCID72563633

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-baa814320a054cda8174a2497cfc73d6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[Br:12][CH2:13][C:14](=[CH:15][CH2:16][c:17]1[c:18]([O:35][CH3:36])[c:19]([CH3:34])[c:20]2[c:24]([c:25]1[O:26][CH2:27][CH2:28][Si:29]([CH3:30])([CH3:31])[CH3:32])[C:23](=[O:33])[O:22][CH2:21]2)[CH2:37][CH3:38].[C:1](#[N:2])[CH2:3][P:4]([O:5][CH2:6][CH3:7])([O:8][CH2:9][CH3:10])=[O:11].[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[Cl-:39].[NH4+:40]>>[C:1](#[N:2])[CH:3]([P:4]([O:5][CH2:6][CH3:7])([O:8][CH2:9][CH3:10])=[O:11])[CH2:13][C:14](=[CH:15][CH2:16][c:17]1[c:18]([O:35][CH3:36])[c:19]([CH3:34])[c:20]2[c:24]([c:25]1[O:26][CH2:27][CH2:28][Si:29]([CH3:30])([CH3:31])[CH3:32])[C:23](=[O:33])[O:22][CH2:21]2)[CH2:37][CH3:38]