HRID2347419

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID1049

Pyridine

C5H5N

HCID6101

4-Methylbenzenesulfonic acid

C7H8O3S

HCID8028

Tetrahydrofuran

C4H8O

HCID28486

Lithium ion

Li+

HCID3280088

未命名化合物

HCID10058088

Bis(trimethylsilyl)peroxide

C6H18O2Si2

结构：CCC(CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)N1C(=O)CCC(c2cccc(Cl)c2)C1c1ccc(Cl)cc1

HCID178454827

未命名化合物

PRODUCTS

生成物

结构：CCC(CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)N1C(=O)C(O)CC(c2cccc(Cl)c2)C1c1ccc(Cl)cc1

HCID77394613

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cd126a46aef94870b25aee17884056c9
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:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][CH2:7][CH:8]([CH2:9][CH3:10])[N:11]1[C:12](=[O:31])[CH2:13][CH2:14][CH:15]([c:24]2[cH:25][c:26]([Cl:30])[cH:27][cH:28][cH:29]2)[CH:16]1[c:17]1[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]1)([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)[c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[CH2:86]1[O:87][CH2:88][CH2:89][CH2:90]1.[CH3:44][Si:45]([N-:46][Si:47]([CH3:48])([CH3:49])[CH3:50])([CH3:51])[CH3:52].[Li+:53].[Na+:85].[O-:81][C:82]([OH:83])=[O:84].[O:54]([Si:55]([CH3:56])([CH3:57])[CH3:58])[O:59][Si:60]([CH3:61])([CH3:62])[CH3:63].[c:64]1([CH3:65])[cH:66][cH:67][c:68]([S:69]([OH:70])(=[O:71])=[O:72])[cH:73][cH:74]1.[n:75]1[cH:76][cH:77][cH:78][cH:79][cH:80]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][CH2:7][CH:8]([CH2:9][CH3:10])[N:11]1[C:12](=[O:31])[CH:13]([OH:54])[CH2:14][CH:15]([c:24]2[cH:25][c:26]([Cl:30])[cH:27][cH:28][cH:29]2)[CH:16]1[c:17]1[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]1)([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)[c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1