Ethyl Acetate → HCID 18963976, compound

HRID 1558272Notes

Reaction equation

HRID 1558272 reaction equation
[CH3:26][N:27]=[C:28]=[O:29].[CH3:36][CH2:37][O:38][C:39]([CH3:40])=[O:41].[O:30]1[CH2:31][CH2:32][O:33][CH2:34][CH2:35]1.[c:1]1([CH2:7][CH2:8][CH2:9][N:10]2[C:11](=[O:25])[c:12]3[cH:13][cH:14][c:15]([O:20][CH2:21][CH2:22][NH:23][OH:24])[cH:16][c:17]3[CH2:18][CH2:19]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][CH2:8][CH2:9][N:10]2[C:11](=[O:25])[c:12]3[cH:13][cH:14][c:15]([O:20][CH2:21][CH2:22][N:23]([OH:24])[C:28]([NH:27][CH3:26])=[O:29])[cH:16][c:17]3[CH2:18][CH2:19]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

5

Reactant 4

HCID 8857Ethyl AcetateHCID 12228Methyl IsocyanateHCID 312751,4-DioxaneHCID 18963940HCID 18963940, compound

Product 1

HCID 18963976HCID 18963976, compound

Sources & evidence

ORD record
ord-32b91defc66c4862991e7c0827255dc2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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