Ethanol → 4-Chloro-1-ethyl-1,5,6,11-tetrahydrobenzo[5,6]cyclohepta[1,2-b]pyrazolo[4,3-e]pyridin-11-ol

HRID 154552Notes

Reaction equation

HRID 154552 reaction equation
[CH3:23][CH2:24][N:25]([CH2:26][CH3:27])[CH2:28][CH3:29].[CH3:30][CH2:31][O:32][C:33](=[O:34])[CH3:35].[CH3:36][CH2:37][OH:38].[Cl:1][c:2]1[c:3]2[c:4]([n:5][c:6]3[c:7]1[cH:8][n:9][n:10]3[CH2:11][CH3:12])[C:13](=[O:22])[c:14]1[c:15]([cH:18][cH:19][cH:20][cH:21]1)[CH2:16][CH2:17]2>>[Cl:1][c:2]1[c:3]2[c:4]([n:5][c:6]3[c:7]1[cH:8][n:9][n:10]3[CH2:11][CH3:12])[CH:13]([OH:22])[c:14]1[c:15]([cH:18][cH:19][cH:20][cH:21]1)[CH2:16][CH2:17]2

Participants

5

Reactant 4

HCID 702EthanolHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 203820734-chloro-1-ethyl-5,6-dihydrobenzo[5,6]-cyclohepta[1,2-b]pyrazolo[4,3-e]pyridin-11(1H)-one

Product 1

HCID 203820924-Chloro-1-ethyl-1,5,6,11-tetrahydrobenzo[5,6]cyclohepta[1,2-b]pyrazolo[4,3-e]pyridin-11-ol

Sources & evidence

ORD record
ord-55d3a68d7ef946a9960726a2cb5ad7bb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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