HRID124949

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID8471

Triethylamine

C6H15N

HCID2756484

tert-Butyl 2-(aminomethyl)pyrrolidine-1-carboxylate

C10H20N2O2

结构：O=C(c1ccc(F)c([N+](=O)[O-])c1)N(CC(F)(F)F)CC(F)(F)F

HCID58911744

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCCC1CNc1ccc(C(=O)N(CC(F)(F)F)CC(F)(F)F)cc1[N+](=O)[O-]

HCID178451692

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-08234dc1a2344308a6fc0a1160d74233
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

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