Water → HCID 178445473, compound

HRID 143078Notes

Reaction equation

HRID 143078 reaction equation
[Br:16][CH2:17][c:18]1[cH:19][cH:20][c:21]([CH2:22][O:23][c:24]2[cH:25][cH:26][c:27]([CH:30]([CH2:31][C:32](=[O:33])[O:34][CH2:35][CH3:36])[C:37]#[C:38][CH3:39])[cH:28][cH:29]2)[cH:40][cH:41]1.[C:42](=[O:43])([O-:44])[O-:45].[CH3:1][N:2]1[CH2:3][C:4]2([c:5]3[cH:6][cH:7][cH:8][cH:9][c:10]31)[CH2:11][CH2:12][NH:13][CH2:14][CH2:15]2.[Cs+:46].[Cs+:47].[O:48]=[CH:49][N:50]([CH3:51])[CH3:52].[OH2:53]>>[CH3:1][N:2]1[CH2:3][C:4]2([c:5]3[cH:6][cH:7][cH:8][cH:9][c:10]31)[CH2:11][CH2:12][N:13]([CH2:17][c:18]1[cH:19][cH:20][c:21]([CH2:22][O:23][c:24]3[cH:25][cH:26][c:27]([CH:30]([CH2:31][C:32](=[O:33])[O:34][CH2:35][CH3:36])[C:37]#[C:38][CH3:39])[cH:28][cH:29]3)[cH:40][cH:41]1)[CH2:14][CH2:15]2

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 106557391-Methyl-1,2-dihydrospiro[indole-3,4'-piperidine]HCID 670873073-[4-(4-Bromomethyl-benzyloxy)-phenyl]-hex-4-ynoic acid ethyl ester

Product 1

HCID 178445473HCID 178445473, compound

Sources & evidence

ORD record
ord-8c6725b9e07d40c19e87b8f75e66c85e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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