Hydrochloric Acid → HCID 178454397, compound

HRID 1545912Notes

Reaction equation

HRID 1545912 reaction equation
[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[Cl:43][CH2:44][Cl:45].[ClH:13].[c:14]1([C:20]2([c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[CH2:21][CH2:22][C:23](=[O:29])[CH:24]3[CH2:25][NH:26][CH2:27][CH:28]23)[cH:15][cH:16][cH:17][cH:18][cH:19]1.[c:1]1([CH:7]([C:8](=[O:9])[OH:10])[CH2:11][CH3:12])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([C:8](=[O:10])[N:26]2[CH2:25][CH:24]3[C:23](=[O:29])[CH2:22][CH2:21][C:20]([c:14]4[cH:15][cH:16][cH:17][cH:18][cH:19]4)([c:30]4[cH:31][cH:32][cH:33][cH:34][cH:35]4)[CH:28]3[CH2:27]2)[CH2:11][CH3:12])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 70122-Phenylbutyric AcidHCID 8471TriethylamineHCID 21264544(3aRS,7aRS)-7,7-Diphenylperhydro-4-isoindolone

Product 1

HCID 178454397HCID 178454397, compound

Sources & evidence

ORD record
ord-f195fa13aea549ccac90e86ce7dac1ff
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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