Isopropanol → HCID 18727452, compound

HRID 1139022Notes

Reaction equation

HRID 1139022 reaction equation
[CH:44]([OH:45])([CH3:46])[CH3:47].[O:29]1[CH:30]([CH2:32][O:33][c:34]2[c:35]3[cH:36][cH:37][cH:38][n:39][c:40]3[cH:41][cH:42][cH:43]2)[CH2:31]1.[c:1]1([CH2:7][CH2:8][CH2:9][CH:10]([CH2:11][CH2:12][CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[NH:20][C:21](=[O:22])[CH:23]2[CH2:24][CH2:25][NH:26][CH2:27][CH2:28]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][CH2:8][CH2:9][CH:10]([CH2:11][CH2:12][CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[NH:20][C:21](=[O:22])[CH:23]2[CH2:24][CH2:25][N:26]([CH2:31][CH:30]([OH:29])[CH2:32][O:33][c:34]3[c:35]4[cH:36][cH:37][cH:38][n:39][c:40]4[cH:41][cH:42][cH:43]3)[CH2:27][CH2:28]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

4

Reactant 3

HCID 3776IsopropanolHCID 112178995-(Oxiran-2-ylmethoxy)quinolineHCID 12020260Piperidine-4-carboxylic acid [4-phenyl-1-(3-phenyl-propyl)-butyl]-amide

Product 1

HCID 18727452HCID 18727452, compound

Sources & evidence

ORD record
ord-b3b9cec27c914d0da905899bcd98c307
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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