Hydrochloric Acid → 2-methyl-1-[5-(methyloxy)-6-nitro-2,3-dihydro-1H-indol-1-yl]-1-oxo-2-propanol

HRID 117221

Reaction equation

HRID 117221 reaction equation
[CH3:2][O:3][c:4]1[cH:5][c:6]2[c:10]([cH:11][c:12]1[N+:13](=[O:14])[O-:15])[NH:9][CH2:8][CH2:7]2.[CH3:40][C:41]([CH3:42])([OH:43])[C:44]([OH:45])=[O:46].[CH:47]([N:48]([CH2:49][CH3:50])[CH:51]([CH3:52])[CH3:53])([CH3:54])[CH3:55].[ClH:1].[O:56]=[CH:57][N:58]([CH3:59])[CH3:60].[P-:16]([F:17])([F:18])([F:19])([F:20])([F:21])[F:22].[n:23]1([O:24][C:25]([N:26]([CH3:27])[CH3:28])=[N+:29]([CH3:30])[CH3:31])[c:32]2[n:33][cH:34][cH:35][cH:36][c:37]2[n:38][n:39]1>>[CH3:2][O:3][c:4]1[cH:5][c:6]2[c:10]([cH:11][c:12]1[N+:13](=[O:14])[O-:15])[N:9]([C:44]([C:41]([CH3:40])([CH3:42])[OH:43])=[O:45])[CH2:8][CH2:7]2

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 116712-Hydroxyisobutyric acidHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 594416565-methoxy-6-nitro-2,3-dihydro-1H-indole

Product 1

HCID 594421262-methyl-1-[5-(methyloxy)-6-nitro-2,3-dihydro-1H-indol-1-yl]-1-oxo-2-propanol

Sources & evidence

ORD record
ord-2fe0d65378954f20b4c61cadb2ab7ad4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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