HRID110567

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID28179

Fluoride

F-

HCID31275

1,4-Dioxane

C4H8O2

结构：C=[CH][Sn]([CH2]CCC)([CH2]CCC)[CH2]CCC

HCID81998

Ethynyltributylstannane

C14H30Sn

HCID83681

Tris(1,1-dimethylethyl)phosphine

C12H27P

HCID104967

Cesium(1+)

Cs+

结构：COCCCOc1cc(COC2CN(C(=O)OC(C)(C)C)CCC2c2ccc(OCCCOCc3ccccc3OC)cc2)ccc1Cl

HCID68504735

未命名化合物

PRODUCTS

生成物

结构：C=Cc1ccc(COC2CN(C(=O)OC(C)(C)C)CCC2c2ccc(OCCCOCc3ccccc3OC)cc2)cc1OCCCOC

HCID68571590

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-817733d05f6f4e1fa560030a554e147c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:66]([P:67]([C:68]([CH3:69])([CH3:70])[CH3:71])[C:72]([CH3:73])([CH3:74])[CH3:75])([CH3:76])([CH3:77])[CH3:78].[CH:51](=[CH2:52])[Sn:53]([CH2:54][CH2:55][CH2:56][CH3:57])([CH2:58][CH2:59][CH2:60][CH3:61])[CH2:62][CH2:63][CH2:64][CH3:65].[Cl:1][c:2]1[c:3]([O:43][CH2:44][CH2:45][CH2:46][O:47][CH3:48])[cH:4][c:5]([CH2:6][O:7][CH:8]2[CH2:9][N:10]([C:34](=[O:35])[O:36][C:37]([CH3:38])([CH3:39])[CH3:40])[CH2:11][CH2:12][CH:13]2[c:14]2[cH:15][cH:16][c:17]([O:20][CH2:21][CH2:22][CH2:23][O:24][CH2:25][c:26]3[c:27]([O:32][CH3:33])[cH:28][cH:29][cH:30][cH:31]3)[cH:18][cH:19]2)[cH:41][cH:42]1.[Cs+:50].[F-:49].[Na+:79].[O:84]1[CH2:85][CH2:86][O:87][CH2:88][CH2:89]1.[OH:80][C:81](=[O:82])[O-:83]>>[c:2]1([CH:51]=[CH2:52])[c:3]([O:43][CH2:44][CH2:45][CH2:46][O:47][CH3:48])[cH:4][c:5]([CH2:6][O:7][CH:8]2[CH2:9][N:10]([C:34](=[O:35])[O:36][C:37]([CH3:38])([CH3:39])[CH3:40])[CH2:11][CH2:12][CH:13]2[c:14]2[cH:15][cH:16][c:17]([O:20][CH2:21][CH2:22][CH2:23][O:24][CH2:25][c:26]3[c:27]([O:32][CH3:33])[cH:28][cH:29][cH:30][cH:31]3)[cH:18][cH:19]2)[cH:41][cH:42]1