HRID1237677

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

3 次

HCID887

Methanol

CH4O

HCID962

Water

H2O

7 次

HCID9321

Hydrazine

H4N2

HCID29936

Fe+3 ion

Fe+3

结构：CC(C)(C)OC(=O)Oc1ccc(C(CN(CCCCCCOCCc2ccc([N+](=O)[O-])cc2)C(=O)OC(C)(C)C)O[Si](C)(C)C(C)(C)C)c2ccc(=O)[nH]c12

HCID123948289

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)Oc1ccc(C(CN(CCCCCCOCCc2ccc(N)cc2)C(=O)OC(C)(C)C)O[Si](C)(C)C(C)(C)C)c2ccc(=O)[nH]c12

HCID123675175

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-be64b11473e8415294820467c2f069db
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[O:8][c:9]1[cH:10][cH:11][c:12]([CH:20]([CH2:21][N:22]([C:23]([O:24][C:25]([CH3:26])([CH3:27])[CH3:28])=[O:29])[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][O:36][CH2:37][CH2:38][c:39]2[cH:40][cH:41][c:42]([N+:45]([O-:46])=[O:47])[cH:43][cH:44]2)[O:48][Si:49]([CH3:50])([CH3:51])[C:52]([CH3:53])([CH3:54])[CH3:55])[c:13]2[cH:14][cH:15][c:16](=[O:19])[nH:17][c:18]12.[CH3:59][OH:60].[Cl-:67].[Cl-:69].[Cl-:70].[Fe+3:68].[NH2:57][NH2:58].[OH2:56].[OH2:61].[OH2:62].[OH2:63].[OH2:64].[OH2:65].[OH2:66]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[O:8][c:9]1[cH:10][cH:11][c:12]([CH:20]([CH2:21][N:22]([C:23]([O:24][C:25]([CH3:26])([CH3:27])[CH3:28])=[O:29])[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][O:36][CH2:37][CH2:38][c:39]2[cH:40][cH:41][c:42]([NH2:45])[cH:43][cH:44]2)[O:48][Si:49]([CH3:50])([CH3:51])[C:52]([CH3:53])([CH3:54])[CH3:55])[c:13]2[cH:14][cH:15][c:16](=[O:19])[nH:17][c:18]12