HRID320704

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID8028

Tetrahydrofuran

C4H8O

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

HCID21867017

O-[2-(Ethenyloxy)ethyl]hydroxylamine

C4H9NO2

结构：COC(=O)c1c(Nc2ccc(I)cc2F)c2cnccc2n1CCO[Si](C(C)C)(C(C)C)C(C)C

HCID59596524

未命名化合物

PRODUCTS

生成物

结构：C=COCCONC(=O)c1c(Nc2ccc(I)cc2F)c2cnccc2n1CCO[Si](C(C)C)(C(C)C)C(C)C

HCID59596663

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-25b8fd60c6664b5181658ab2d1c16883
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

[CH2:78]1[O:79][CH2:80][CH2:81][CH2:82]1.[CH3:1][O:2][C:3](=[O:4])[c:5]1[c:6]([NH:27][c:28]2[c:29]([F:35])[cH:30][c:31]([I:34])[cH:32][cH:33]2)[c:7]2[cH:8][n:9][cH:10][cH:11][c:12]2[n:13]1[CH2:14][CH2:15][O:16][Si:17]([CH:18]([CH3:19])[CH3:20])([CH:21]([CH3:22])[CH3:23])[CH:24]([CH3:25])[CH3:26].[CH3:45][CH2:46][N:47]=[C:48]=[N:49][CH2:50][CH2:51][CH2:52][N:53]([CH3:54])[CH3:55].[CH3:75][CH2:76][OH:77].[CH:38](=[CH2:39])[O:40][CH2:41][CH2:42][O:43][NH2:44].[CH:66]([N:67]([CH2:68][CH3:69])[CH:70]([CH3:71])[CH3:72])([CH3:73])[CH3:74].[Na+:37].[OH-:36].[OH:56][n:57]1[c:58]2[c:59]([cH:60][cH:61][cH:62][cH:63]2)[n:64][n:65]1>>[C:3](=[O:4])([c:5]1[c:6]([NH:27][c:28]2[c:29]([F:35])[cH:30][c:31]([I:34])[cH:32][cH:33]2)[c:7]2[cH:8][n:9][cH:10][cH:11][c:12]2[n:13]1[CH2:14][CH2:15][O:16][Si:17]([CH:18]([CH3:19])[CH3:20])([CH:21]([CH3:22])[CH3:23])[CH:24]([CH3:25])[CH3:26])[NH:44][O:43][CH2:42][CH2:41][O:40][CH:38]=[CH2:39]