HRID189793

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID1366

Cyclohexanecarboxylic acid, 1-amino-

C7H13NO2

HCID6344

Dichloromethane

CH2Cl2

HCID31275

1,4-Dioxane

C4H8O2

HCID34367

1-(9-Fluorenyl)methyl chloroformate

C15H11ClO2

HCID81531

Diisopropylethylamine

C8H19N

PRODUCTS

生成物

结构：NC1(C(=O)O)CCCCC1C(=O)OCC1c2ccccc2-c2ccccc21

HCID56923993

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-647718148fa648b78aabbc7ee5d9290b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[C:11](=[O:12])([O:13][CH2:14][CH:15]1[c:16]2[cH:17][cH:18][cH:19][cH:20][c:21]2-[c:22]2[cH:23][cH:24][cH:25][cH:26][c:27]21)[Cl:28].[CH3:49][OH:50].[CH:29]([N:30]([CH:31]([CH3:32])[CH3:33])[CH2:34][CH3:35])([CH3:36])[CH3:37].[Cl:46][CH2:47][Cl:48].[NH2:1][C:2]1([C:8](=[O:9])[OH:10])[CH2:3][CH2:4][CH2:5][CH2:6][CH2:7]1.[Na+:39].[O:40]1[CH2:41][CH2:42][O:43][CH2:44][CH2:45]1.[OH-:38]>>[NH2:1][C:2]1([C:8](=[O:9])[OH:10])[CH:3]([C:11](=[O:12])[O:13][CH2:14][CH:15]2[c:16]3[cH:17][cH:18][cH:19][cH:20][c:21]3-[c:22]3[cH:23][cH:24][cH:25][cH:26][c:27]32)[CH2:4][CH2:5][CH2:6][CH2:7]1