Isopropanol → HCID 135838364, compound

HRID 2130711Notes

Reaction equation

HRID 2130711 reaction equation
[CH2:22]([c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1)[N:29]1[CH2:30][CH2:31][NH:32][CH2:33][CH2:34]1.[CH:35]([OH:36])([CH3:37])[CH3:38].[Cl:1][c:2]1[n:3][c:4]2[n:5]([c:6]3[c:7]([n+:8]([O-:10])[cH:9]2)[C:11]([c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)=[CH:12][CH2:13][NH:14]3)[cH:21]1>>[c:2]1([N:32]2[CH2:31][CH2:30][N:29]([CH2:22][c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[CH2:34][CH2:33]2)[n:3][c:4]2[n:5]([c:6]3[c:7]([n+:8]([O-:10])[cH:9]2)[C:11]([c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)=[CH:12][CH2:13][NH:14]3)[cH:21]1

Participants

4

Reactant 3

HCID 3776IsopropanolHCID 759941-BenzylpiperazineHCID 135838365HCID 135838365, compound

Product 1

HCID 135838364HCID 135838364, compound

Sources & evidence

ORD record
ord-af50c7d1810f4fa7b54bbcf68fff627f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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