HRID91102

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID10685

1H-Indole-3-ethanol

C10H11NO

HCID62406

未命名化合物

HCID67408596

未命名化合物

PRODUCTS

生成物

结构：CC1CC(c2ccccc2)(N(C)C)CCC12OCCc1c2[nH]c2ccccc12

HCID44224247

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-30dee8b2abb0409aa577670764862a17
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:1][N:2]([C:3]1([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[CH2:4][CH:5]([CH3:10])[C:6](=[O:9])[CH2:7][CH2:8]1)[CH3:17].[CH3:43][CH2:44][OH:45].[Cl:40][CH2:41][Cl:42].[F:30][C:31]([F:32])([F:33])[S:34]([OH:35])(=[O:36])=[O:37].[Na+:39].[OH-:38].[OH2:46].[OH:18][CH2:19][CH2:20][c:21]1[cH:22][nH:23][c:24]2[cH:25][cH:26][cH:27][cH:28][c:29]12>>[CH3:1][N:2]([C:3]1([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[CH2:4][CH:5]([CH3:10])[C:6]2([CH2:7][CH2:8]1)[O:9][CH2:19][CH2:20][c:21]1[c:22]2[nH:23][c:24]2[cH:25][cH:26][cH:27][cH:28][c:29]12)[CH3:17]