HRID955563

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID4003555

4-Adamantan-1-yl-2-methyl-phenylamine

C17H23N

HCID11471072

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(C23CC4CC(CC(C4)C2)C3)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Br

HCID12087761

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ce343e2138b84360a5d78b5076fbde11
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[Br:32][c:33]1[c:34]([C:35](=[O:36])[Cl:37])[cH:38][c:39]([N+:42](=[O:43])[O-:44])[cH:40][cH:41]1.[C:7]12([c:17]3[cH:18][c:19]([CH3:24])[c:20]([NH2:21])[cH:22][cH:23]3)[CH2:8][CH:9]3[CH2:10][CH:11]([CH2:12][CH:13]([CH2:14]1)[CH2:15]3)[CH2:16]2.[CH3:25][CH2:26][N:27]([CH2:28][CH3:29])[CH2:30][CH3:31].[ClH:6].[O:1]1[CH2:2][CH2:3][CH2:4][CH2:5]1.[OH2:45]>>[C:7]12([c:17]3[cH:18][c:19]([CH3:24])[c:20]([NH:21][C:35]([c:34]4[c:33]([Br:32])[cH:41][cH:40][c:39]([N+:42](=[O:43])[O-:44])[cH:38]4)=[O:36])[cH:22][cH:23]3)[CH2:8][CH:9]3[CH2:10][CH:11]([CH2:12][CH:13]([CH2:14]1)[CH2:15]3)[CH2:16]2