HRID2324706

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID1140

Toluene

C7H8

HCID28123

Tetrahydroborate

H4B-

HCID57617860

未命名化合物

结构：CC1C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)OC(=O)N1Cc1cc(OC(F)(F)F)ccc1N

HCID76626792

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)CC1CCC(CNc2ccc(OC(F)(F)F)cc2CN2C(=O)OC(c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2C)CC1

HCID178470666

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c8ce8800eec242c8af70b5399e4558cc
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[BH4-:49].[CH3:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1.[CH:35](=[O:36])[CH:37]1[CH2:38][CH2:39][CH:40]([CH2:43][C:44](=[O:45])[O:46][CH2:47][CH3:48])[CH2:41][CH2:42]1.[NH2:1][c:2]1[c:3]([CH2:4][N:5]2[C:6](=[O:25])[O:7][CH:8]([c:11]3[cH:12][c:13]([C:21]([F:22])([F:23])[F:24])[cH:14][c:15]([C:17]([F:18])([F:19])[F:20])[cH:16]3)[CH:9]2[CH3:10])[cH:26][c:27]([O:30][C:31]([F:32])([F:33])[F:34])[cH:28][cH:29]1.[Na+:50]>>[NH:1]([c:2]1[c:3]([CH2:4][N:5]2[C:6](=[O:25])[O:7][CH:8]([c:11]3[cH:12][c:13]([C:21]([F:22])([F:23])[F:24])[cH:14][c:15]([C:17]([F:18])([F:19])[F:20])[cH:16]3)[CH:9]2[CH3:10])[cH:26][c:27]([O:30][C:31]([F:32])([F:33])[F:34])[cH:28][cH:29]1)[CH2:35][CH:37]1[CH2:38][CH2:39][CH:40]([CH2:43][C:44](=[O:45])[O:46][CH2:47][CH3:48])[CH2:41][CH2:42]1