HRID817019

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

2 次

HCID6101

4-Methylbenzenesulfonic acid

C7H8O3S

HCID19660

Carbonate

CO3-2

结构：CN(C(=O)c1cccc(C(O)(c2cccc(O[Si](C)(C)C(C)(C)C)c2)C2CCN(C(=O)OC(C)(C)C)CC2)c1)c1cccc(F)c1

HCID69790890

未命名化合物

PRODUCTS

生成物

结构：CN(C(=O)c1cccc(C(=C2CCN(C(=O)OC(C)(C)C)CC2)c2cccc(O[Si](C)(C)C(C)(C)C)c2)c1)c1cccc(F)c1

HCID69914374

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6e7a8823e63c4ddd93d723fe05bb138e
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([C:14]([OH:15])([c:16]2[cH:17][c:18]([C:22]([N:23]([CH3:24])[c:25]3[cH:26][c:27]([F:31])[cH:28][cH:29][cH:30]3)=[O:32])[cH:19][cH:20][cH:21]2)[c:33]2[cH:34][c:35]([O:39][Si:40]([CH3:41])([CH3:42])[C:43]([CH3:44])([CH3:45])[CH3:46])[cH:36][cH:37][cH:38]2)[CH2:12][CH2:13]1.[C:59](=[O:60])([O-:61])[O-:62].[Na+:63].[Na+:64].[OH2:47].[OH2:65].[c:48]1([CH3:49])[cH:50][cH:51][c:52]([S:53]([OH:54])(=[O:55])=[O:56])[cH:57][cH:58]1.[cH:66]1[cH:67][cH:68][cH:69][cH:70][cH:71]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11](=[C:14]([c:16]2[cH:17][c:18]([C:22]([N:23]([CH3:24])[c:25]3[cH:26][c:27]([F:31])[cH:28][cH:29][cH:30]3)=[O:32])[cH:19][cH:20][cH:21]2)[c:33]2[cH:34][c:35]([O:39][Si:40]([CH3:41])([CH3:42])[C:43]([CH3:44])([CH3:45])[CH3:46])[cH:36][cH:37][cH:38]2)[CH2:12][CH2:13]1