Water → HCID 7184161, compound

HRID 89299Notes

Reaction equation

[CH:1]([N:2]([CH:3]([CH3:4])[CH3:5])[CH2:6][CH3:7])([CH3:8])[CH3:9].[NH2:19][c:20]1[cH:21][cH:22][c:23]([C:26](=[O:27])[O:28][CH3:29])[cH:24][cH:25]1.[O:55]=[CH:56][N:57]([CH3:58])[CH3:59].[OH2:54].[OH:10][C:11](=[O:12])[c:13]1[cH:14][cH:15][cH:16][cH:17][n:18]1.[P-:30]([F:31])([F:32])([F:33])([F:34])([F:35])[F:36].[n:37]1([O:38][C:39]([N:40]([CH3:41])[CH3:42])=[N+:43]([CH3:44])[CH3:45])[c:46]2[n:47][cH:48][cH:49][cH:50][c:51]2[n:52][n:53]1>>[C:11](=[O:12])([c:13]1[cH:14][cH:15][cH:16][cH:17][n:18]1)[NH:19][c:20]1[cH:21][cH:22][c:23]([C:26](=[O:27])[O:28][CH3:29])[cH:24][cH:25]1

Participants

Reactant 7

HCID 962Water

HCID 1018Picolinic acid

HCID 6228Dimethylformamide

HCID 9886Hexafluorophosphate

HCID 12082Methyl 4-aminobenzoate

HCID 81531Diisopropylethylamine

HCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium

Product 1

HCID 7184161HCID 7184161, compound

Sources & evidence

ORD record: ord-e1a51f7925184b9f96690c901dafd473
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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