Water → HCID 86616535, compound

HRID 2313687Notes

Reaction equation

HRID 2313687 reaction equation
[CH2:28]([c:29]1[cH:30][c:31]2[c:35]([cH:36][cH:37]1)[O:34][CH2:33][O:32]2)[N:38]1[CH2:39][CH2:40][NH:41][CH2:42][CH2:43]1.[O:45]=[CH:46][N:47]([CH3:48])[CH3:49].[OH2:44].[c:1]1([O:2][C:8]([NH:9][c:10]2[cH:11][cH:12][c:13]([O:16][c:17]3[c:18]([F:26])[cH:19][c:20]([N+:23](=[O:24])[O-:25])[cH:21][cH:22]3)[cH:14][cH:15]2)=[O:27])[cH:3][cH:4][cH:5][cH:6][cH:7]1>>[C:8]([NH:9][c:10]1[cH:11][cH:12][c:13]([O:16][c:17]2[c:18]([F:26])[cH:19][c:20]([N+:23](=[O:24])[O-:25])[cH:21][cH:22]2)[cH:14][cH:15]1)(=[O:27])[N:41]1[CH2:40][CH2:39][N:38]([CH2:28][c:29]2[cH:30][c:31]3[c:35]([cH:36][cH:37]2)[O:34][CH2:33][O:32]3)[CH2:43][CH2:42]1

Participants

5

Reactant 4

HCID 962WaterHCID 6228DimethylformamideHCID 944261-PiperonylpiperazineHCID 68527058HCID 68527058, compound

Product 1

HCID 86616535HCID 86616535, compound

Sources & evidence

ORD record
ord-cd9d429f9b2e464696238bc876183e64
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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