HRID829737

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID227

Anthranilic acid

C7H7NO2

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID26255

Tetrafluoroborate

BF4-

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

未命名化合物

结构：CC(C)(C)OC(=O)N1Cc2cc(N)ccc2C(C)(C)C1

HCID21959561

tert-Butyl 7-amino-4,4-dimethyl-3,4-dihydroisoquinoline-2(1H)-carboxylate

C16H24N2O2

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1Cc2cc(NC(=O)c3ccccc3N)ccc2C(C)(C)C1

HCID69510706

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2653d6c67a764cb082c109381864c944
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[B-:31]([F:32])([F:33])([F:34])[F:35].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][c:10]2[cH:11][c:12]([NH2:20])[cH:13][cH:14][c:15]2[C:16]([CH3:18])([CH3:19])[CH2:17]1.[CH3:67][CH2:68][O:69][C:70]([CH3:71])=[O:72].[CH:53]([N:54]([CH2:55][CH3:56])[CH:57]([CH3:58])[CH3:59])([CH3:60])[CH3:61].[NH2:21][c:22]1[c:23]([C:24](=[O:25])[OH:26])[cH:27][cH:28][cH:29][cH:30]1.[O:62]=[CH:63][N:64]([CH3:65])[CH3:66].[OH2:73].[n:36]1([O:37][C:38]([N:39]([CH3:40])[CH3:41])=[N+:42]([CH3:43])[CH3:44])[c:45]2[cH:46][cH:47][cH:48][cH:49][c:50]2[n:51][n:52]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][c:10]2[cH:11][c:12]([NH:20][C:24]([c:23]3[c:22]([NH2:21])[cH:30][cH:29][cH:28][cH:27]3)=[O:25])[cH:13][cH:14][c:15]2[C:16]([CH3:18])([CH3:19])[CH2:17]1