Ethyl Acetate → HCID 515596, compound

HRID 194791Notes

Reaction equation

HRID 194791 reaction equation
[CH3:14][N:15]1[CH2:16][CH2:17][NH:18][CH2:19][CH2:20]1.[CH3:30][CH2:31][O:32][C:33](=[O:34])[CH3:35].[CH:21]([N:22]([CH2:23][CH3:24])[CH:25]([CH3:26])[CH3:27])([CH3:28])[CH3:29].[Cl:1][C:2](=[O:3])[O:4][c:5]1[cH:6][cH:7][c:8]([N+:11](=[O:12])[O-:13])[cH:9][cH:10]1>>[C:2](=[O:3])([O:4][c:5]1[cH:6][cH:7][c:8]([N+:11](=[O:12])[O-:13])[cH:9][cH:10]1)[N:18]1[CH2:17][CH2:16][N:15]([CH3:14])[CH2:20][CH2:19]1

Participants

5

Reactant 4

HCID 8857Ethyl AcetateHCID 531671-MethylpiperazineHCID 81531DiisopropylethylamineHCID 821294-Nitrophenyl chloroformate

Product 1

HCID 515596HCID 515596, compound

Sources & evidence

ORD record
ord-a51d7f70000646759fd17ebeed1f114c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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