Hydrochloric Acid → Hydrochloric Acid

HRID 316867Notes

Reaction equation

HRID 316867 reaction equation
[Al+3:29].[CH2:1]([O:2][C:4](=[O:3])[NH:6][c:7]1[c:8]([N:13]2[CH2:14][C:15]3([c:16]4[cH:17][cH:18][cH:19][cH:20][c:21]42)[CH2:22][CH2:23][N:24]([CH3:27])[CH2:25][CH2:26]3)[cH:9][cH:10][cH:11][cH:12]1)[CH3:5].[CH:42]([OH:43])([CH3:44])[CH3:45].[ClH:36].[H-:28].[H-:31].[H-:32].[H-:33].[Li+:30].[Na+:35].[O:37]1[CH2:38][CH2:39][CH2:40][CH2:41]1.[OH-:34].[OH2:46]>>[CH3:4][NH:6][c:7]1[c:8]([N:13]2[CH2:14][C:15]3([c:16]4[cH:17][cH:18][cH:19][cH:20][c:21]42)[CH2:22][CH2:23][N:24]([CH3:27])[CH2:25][CH2:26]3)[cH:9][cH:10][cH:11][cH:12]1.[ClH:36]

Participants

12

Reactant 10

HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 3776IsopropanolHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 104727Aluminum CationHCID 166653Hydride4×HCID 128016081-[2-(Ethoxycarbonyl)aminophenyl]-1'-methylspiro[indoline-3,4'-piperidine]

Product 2

HCID 313Hydrochloric AcidHCID 12801609N-methyl-2-(1'-methylspiro[2H-indole-3,4'-piperidine]-1-yl)aniline

Sources & evidence

ORD record
ord-3335530edad94211b313298910550e52
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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