Water → Tert-butyl 9'-(trifluoromethyl)spiro-[piperidine-4,6'-pyrido[2,3-b]pyrrolo[1,2-d][1,4]oxazine]-1-carboxylate

HRID 1217283Notes

Reaction equation

HRID 1217283 reaction equation
[F:26][C:27]([s+:28]1[c:29]2[cH:30][cH:31][cH:32][cH:33][c:34]2[c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]12)([F:41])[F:42].[O:44]=[CH:45][N:46]([CH3:47])[CH3:48].[OH2:43].[cH:1]1[cH:2][cH:3][n:4][c:5]2[c:22]1-[n:21]1[c:20]([cH:25][cH:24][cH:23]1)[C:7]1([O:6]2)[CH2:8][CH2:9][N:10]([C:13](=[O:14])[O:15][C:16]([CH3:17])([CH3:18])[CH3:19])[CH2:11][CH2:12]1>>[cH:1]1[cH:2][cH:3][n:4][c:5]2[c:22]1-[n:21]1[c:20]([cH:25][cH:24][c:23]1[C:27]([F:26])([F:41])[F:42])[C:7]1([O:6]2)[CH2:8][CH2:9][N:10]([C:13](=[O:14])[O:15][C:16]([CH3:17])([CH3:18])[CH3:19])[CH2:11][CH2:12]1

Participants

5

Reactant 4

HCID 962WaterHCID 6228DimethylformamideHCID 27775055-(Trifluoromethyl)dibenzothiophen-5-iumHCID 58551499Tert-butyl spiro[piperidine-4,6'-pyrido[2,3-b]pyrrolo[1,2-d][1,4]oxazine]-1-carboxylate

Product 1

HCID 67465074Tert-butyl 9'-(trifluoromethyl)spiro-[piperidine-4,6'-pyrido[2,3-b]pyrrolo[1,2-d][1,4]oxazine]-1-carboxylate

Sources & evidence

ORD record
ord-c046ea41a7314a8f83a4525f3d99dada
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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