Water → HCID 69382578, compound

HRID 161626Notes

Reaction equation

HRID 161626 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[c:11]1[cH:12][c:13]([Br:34])[c:14]2[c:15]3[c:16]([nH:17][c:18]2[c:19]1[CH3:20])[C:21]([CH2:25][CH2:26][CH3:27])([CH2:28][C:29](=[O:30])[O:31][CH2:32][CH3:33])[O:22][CH2:23][CH2:24]3.[CH3:35][N:36]1[CH2:37][CH2:38][CH2:39][C:40]1=[O:41].[CH3:46][CH2:47][O:48][C:49]([CH3:50])=[O:51].[Cu:42][C:43]#[N:44].[OH2:45]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[c:11]1[cH:12][c:13]([C:35]#[N:36])[c:14]2[c:15]3[c:16]([nH:17][c:18]2[c:19]1[CH3:20])[C:21]([CH2:25][CH2:26][CH3:27])([CH2:28][C:29](=[O:30])[O:31][CH2:32][CH3:33])[O:22][CH2:23][CH2:24]3

Participants

6

Reactant 5

HCID 962WaterHCID 8857Ethyl AcetateHCID 13387N-methyl-2-pyrrolidoneHCID 69383342HCID 69383342, compoundHCID 178418546HCID 178418546, compound

Product 1

HCID 69382578HCID 69382578, compound

Sources & evidence

ORD record
ord-e565a65a0e1d422a9a2f37c55c83ad5c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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