HRID1147301

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6456

Trityl chloride

C19H15Cl

HCID166653

Hydride

H-

HCID1484491

dimethyl 1H-pyrazole-3,5-dicarboxylate

C7H8N2O4

结构：CCOC(=O)c1cnn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c1

HCID10523968

Ethyl 1-tritylpyrazole-4-carboxylate

C25H22N2O2

PRODUCTS

生成物

结构：COC(=O)c1cc(C(=O)OC)n(C(c2ccccc2)(c2ccccc2)c2ccccc2)n1

HCID12377531

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a666d81068a844dfa384955bb0b02676
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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