HRID2154854

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID712

Formaldehyde

CH2O

HCID947

Nitrogen

HCID7912

Diisopropylamine

C6H15N

HCID8028

Tetrahydrofuran

C4H8O

HCID28486

Lithium ion

Li+

HCID5062348

未命名化合物

结构：COC(=O)CC1(C)CC(c2cccc(Cl)c2)C(c2ccc(Cl)cc2)N(C(CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)C2CC2)C1=O

HCID76834392

未命名化合物

HCID178418339

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(CO)C1(C)CC(c2cccc(Cl)c2)C(c2ccc(Cl)cc2)N(C(CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)C2CC2)C1=O

HCID76834556

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d096b52f5d314f47ac0bef60f906c837
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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