Ammonia → HCID 135526551, compound

HRID 97956Notes

Reaction equation

HRID 97956 reaction equation
[Cl:47][CH2:48][Cl:49].[Cl:50][CH:51]([Cl:52])[Cl:53].[F:3][C:4]([F:5])([F:7])[C:8](=[O:6])[O:9][C:10](=[O:11])[C:12]([F:13])([F:14])[F:15].[F:40][C:41]([F:42])([F:43])[C:44]([OH:45])=[O:46].[NH3:54].[O:16]1[CH2:17][CH2:18][N:19]([CH2:23][CH2:24][NH:25][c:26]2[n:27][n+:28]([O-:39])[c:29]3[c:30]([n:31]2)[cH:32][c:33]2[c:37]([cH:38]3)[CH2:36][CH2:35][CH2:34]2)[CH2:20][CH2:21][CH2:22]1.[OH:1][OH:2]>>[O-:6][n+:31]1[c:26]([NH:25][CH2:24][CH2:23][N:19]2[CH2:18][CH2:17][O:16][CH2:22][CH2:21][CH2:20]2)[n:27][n+:28]([O-:39])[c:29]2[c:30]1[cH:32][c:33]1[c:37]([cH:38]2)[CH2:36][CH2:35][CH2:34]1

Participants

8

Reactant 7

HCID 222AmmoniaHCID 784Hydrogen PeroxideHCID 6212ChloroformHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 9845Trifluoroacetic anhydrideHCID 11951287N-[2-(1,4-Oxazepan-4-yl)ethyl]-7,8-dihydro-6H-indeno[5,6-e][1,2,4]triazin-3-amine 1-Oxide

Product 1

HCID 135526551HCID 135526551, compound

Sources & evidence

ORD record
ord-1bcd22afadd24e368357cd1b37d01826
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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