HRID2316321

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID13345

Triethyl phosphonoacetate

C8H17O5P

HCID75676

Diethyl (cyanomethyl)phosphonate

C6H12NO3P

结构：CCOC(=O)C=C1CCC(c2cc(N(COCC[Si](C)(C)C)COCC[Si](C)(C)C)n3nccc3n2)CC1

HCID66733552

未命名化合物

PRODUCTS

生成物

结构：C[Si](C)(C)CCOCN(COCC[Si](C)(C)C)c1cc(C2CCC(=CC#N)CC2)nc2ccnn12

HCID66739719

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-01c841b952b4484c81756f5c6cc0559f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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