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Ammonium → 5-(Aminocarbonyl)-3-pyridyl 4-[2-(3-cyanophenyl)ethyl]-1-piperidinecarboxylate

HRID 689449
Notes
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Reaction equation

HRID 689449 reaction equation
[C:25](#[N:26])[c:27]1[cH:28][c:29]([CH2:33][CH2:34][CH:35]2[CH2:36][CH2:37][N:38]([C:41](=[O:42])[O:43][c:44]3[cH:45][n:46][cH:47][c:48]([C:49](=[O:50])[OH:51])[cH:52]3)[CH2:39][CH2:40]2)[cH:30][cH:31][cH:32]1.[CH3:2][N:3]([CH3:4])[CH2:5][CH2:6][CH2:7][N:8]=[C:9]=[N:10][CH2:11][CH3:12].[Cl-:23].[ClH:1].[NH4+:24].[Na+:53].[O:58]=[CH:59][N:60]([CH3:61])[CH3:62].[OH:13][n:14]1[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]2[n:21][n:22]1.[OH:54][C:55](=[O:56])[O-:57]>>[NH2:3][C:49]([c:48]1[cH:47][n:46][cH:45][c:44]([O:43][C:41]([N:38]2[CH2:37][CH2:36][CH:35]([CH2:34][CH2:33][c:29]3[cH:28][c:27]([C:25]#[N:26])[cH:32][cH:31][cH:30]3)[CH2:40][CH2:39]2)=[O:42])[cH:52]1)=[O:50]
ParticipantsSources & evidenceReaction notes

Participants

10

Reactant 9

HCID 223AmmoniumHCID 312ChlorideHCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium IonHCID 6228DimethylformamideHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide
HCID 75771
1-Hydroxybenzotriazole
HCID 575078155-[({4-[2-(3-Cyanophenyl)ethyl]-1-piperidyl}carbonyl)oxy]nicotinic acid

Product 1

HCID 159509115-(Aminocarbonyl)-3-pyridyl 4-[2-(3-cyanophenyl)ethyl]-1-piperidinecarboxylate

Sources & evidence

ORD record
ord-b08a5afb03f54b6194936bfb74c1cfd3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes