Hydrochloric Acid → HCID 67683117, compound

HRID 1216149Notes

Reaction equation

HRID 1216149 reaction equation
[CH2:2]1[CH2:3][CH2:4][CH2:5][C:6]12[CH2:7][CH2:8][NH:9][CH2:10][CH2:11]2.[CH3:12][CH2:13][N:14]([CH2:15][CH3:16])[CH2:17][CH3:18].[CH3:64][N:65]([CH3:66])[CH:67]=[O:68].[CH3:69][CH2:70][O:71][C:72](=[O:73])[CH3:74].[ClH:1].[O:19]([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)[c:26]1[cH:27][cH:28][c:29]([O:32][C:33](=[O:34])[NH:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][O:42][C:43](=[O:44])[N:45]2[CH2:46][CH2:47][CH:48]([O:51][C:52](=[O:53])[O:54][c:55]3[cH:56][cH:57][c:58]([N+:59]([O-:60])=[O:61])[cH:62][cH:63]3)[CH2:49][CH2:50]2)[cH:30][cH:31]1>>[CH2:2]1[CH2:3][CH2:4][CH2:5][C:6]12[CH2:7][CH2:8][N:9]([C:52]([O:51][CH:48]1[CH2:47][CH2:46][N:45]([C:43]([O:42][CH2:41][CH2:40][CH2:39][CH2:38][CH2:37][CH2:36][NH:35][C:33]([O:32][c:29]3[cH:28][cH:27][c:26]([O:19][c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[cH:31][cH:30]3)=[O:34])=[O:44])[CH2:50][CH2:49]1)=[O:53])[CH2:10][CH2:11]2

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 4371528-Azaspiro[4.5]decaneHCID 152933074-(4-Nitro-phenoxycarbonyloxy)-piperidine-1-carboxylic acid 6-[(4-phenoxy-phenyl)-oxycarbonylamino]-hexyl ester

Product 1

HCID 67683117HCID 67683117, compound

Sources & evidence

ORD record
ord-77c6bc8198b2485a8137216fbd8dc21e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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