Water → HCID 86615501, compound

HRID 205455Notes

Reaction equation

HRID 205455 reaction equation
[CH3:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[NH2:1][c:2]1[c:3]([O:4][c:5]2[cH:6][c:7]([CH:11]([CH3:12])[OH:13])[cH:8][cH:9][cH:10]2)[cH:14][cH:15][c:16]([Cl:18])[cH:17]1.[OH2:36].[c:19]1([P:20]([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)(=[O:27])[N:33]=[N+:34]=[N-:35])[cH:28][cH:29][cH:30][cH:31][cH:32]1>>[NH2:1][c:2]1[c:3]([O:4][c:5]2[cH:6][c:7]([CH:11]([CH3:12])[N:33]=[N+:34]=[N-:35])[cH:8][cH:9][cH:10]2)[cH:14][cH:15][c:16]([Cl:18])[cH:17]1

Participants

5

Sources & evidence

ORD record
ord-efdb60a6613349a28a036643fd47071d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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