Water → HCID 70590893, compound

HRID 1142631Notes

Reaction equation

HRID 1142631 reaction equation
[CH2:44]([Cl:45])[Cl:46].[CH3:26][C:27]([Cl:28])=[O:29].[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([CH2:6][O:7][C:8](=[O:9])[NH:10][CH:11]2[CH:12]3[CH2:13][CH2:14][O:15][C:16]([CH3:20])([CH3:21])[N:17]3[C:18]2=[O:19])[cH:22][cH:23][cH:24][cH:25]1.[OH2:43].[OH:36][C:37]([C:38]([F:39])([F:40])[F:41])=[O:42].[cH:30]1[cH:31][cH:32][n:33][cH:34][cH:35]1>>[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([CH2:6][O:7][C:8](=[O:9])[NH:10][CH:11]2[CH:12]([CH2:13][CH2:14][O:15][C:16]([CH3:20])=[O:29])[NH:17][C:18]2=[O:19])[cH:22][cH:23][cH:24][cH:25]1

Participants

7

Reactant 6

HCID 962WaterHCID 1049PyridineHCID 6344DichloromethaneHCID 6367Acetyl chlorideHCID 6422Trifluoroacetic acidHCID 21163111HCID 21163111, compound

Product 1

HCID 70590893HCID 70590893, compound

Sources & evidence

ORD record
ord-577a3e4159cb42969a460719ff68cee8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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