Hydrochloric Acid → Hydrochloric Acid

HRID 145174

Reaction equation

HRID 145174 reaction equation
[CH3:49][CH2:50][OH:51].[Cl:39][CH2:40][CH:41]([Cl:42])[CH3:43].[ClH:38].[N+:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][c:7]1[OH:8])([O-:9])=[O:10].[N:27]1([CH:32]2[CH2:33][CH2:34][NH:35][CH2:36][CH2:37]2)[CH2:28][CH2:29][CH2:30][CH2:31]1.[O:44]=[CH:45][N:46]([CH3:47])[CH3:48].[c:11]1(-[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[cH:12][cH:13][c:14]([CH2:17][C:18](=[O:19])[OH:20])[cH:15][cH:16]1>>[ClH:38].[c:11]1(-[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[cH:12][cH:13][c:14]([CH2:17][C:18](=[O:20])[N:35]2[CH2:34][CH2:33][CH:32]([N:27]3[CH2:28][CH2:29][CH2:30][CH2:31]3)[CH2:37][CH2:36]2)[cH:15][cH:16]1

Participants

9

Reactant 7

HCID 313Hydrochloric AcidHCID 702EthanolHCID 3332FelbinacHCID 6228DimethylformamideHCID 65641,2-DichloropropaneHCID 69472-NitrophenolHCID 787034-(1-Pyrrolidinyl)piperidine

Product 2

HCID 313Hydrochloric AcidHCID 220546442-(4-Phenylphenyl)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone

Sources & evidence

ORD record
ord-d4aa4bcfb18f4a20a7ff74bafe0c2fef
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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