Bicarbonate Ion → tert-butyl 5-chloro-1-[5-methyl-7-(4-nitrobenzoyl)oxy-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1'-carboxylate

HRID 2332683Notes

Reaction equation

HRID 2332683 reaction equation
[Cl:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[N:7]([c:11]1[c:12]3[c:13]([n:14][cH:15][n:16]1)[CH:17]([OH:21])[CH2:18][CH:19]3[CH3:20])[CH2:6][C:5]21[CH2:22][CH2:23][N:24]([C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[CH2:25][CH2:26]1.[Cl:46][CH2:47][Cl:48].[N+:34](=[O:35])([O-:36])[c:37]1[cH:38][cH:39][c:40]([C:41](=[O:42])[Cl:43])[cH:44][cH:45]1.[Na+:53].[O-:49][C:50]([OH:51])=[O:52]>>[Cl:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[N:7]([c:11]1[c:12]3[c:13]([n:14][cH:15][n:16]1)[CH:17]([O:21][C:41]([c:40]1[cH:39][cH:38][c:37]([N+:34](=[O:35])[O-:36])[cH:45][cH:44]1)=[O:42])[CH2:18][CH:19]3[CH3:20])[CH2:6][C:5]21[CH2:22][CH2:23][N:24]([C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[CH2:25][CH2:26]1

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6344DichloromethaneHCID 85024-Nitrobenzoyl chlorideHCID 178428895HCID 178428895, compound

Product 1

HCID 178429143tert-butyl 5-chloro-1-[5-methyl-7-(4-nitrobenzoyl)oxy-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1'-carboxylate

Sources & evidence

ORD record
ord-b471b2dd1f0a4295830b6e302d86c6ae
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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