Hydrochloric Acid → HCID 67915859, compound

HRID 2125852Notes

Reaction equation

HRID 2125852 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][c:9]1[c:10]([CH2:15][C:16](=[O:17])[OH:18])[cH:11][cH:12][cH:13][cH:14]1.[CH3:42][CH2:43][N:44]([CH2:45][CH3:46])[CH2:47][CH3:48].[Cl:49][CH2:50][Cl:51].[ClH:19].[c:20]1([C:26]2([c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[CH2:27][CH2:28][C:29](=[O:35])[CH:30]3[CH2:31][NH:32][CH2:33][CH:34]23)[cH:21][cH:22][cH:23][cH:24][cH:25]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][c:9]1[c:10]([CH2:15][C:16](=[O:18])[N:32]2[CH2:31][CH:30]3[C:29](=[O:35])[CH2:28][CH2:27][C:26]([c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)([c:36]4[cH:37][cH:38][cH:39][cH:40][cH:41]4)[CH:34]3[CH2:33]2)[cH:11][cH:12][cH:13][cH:14]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 8471TriethylamineHCID 17890355{2-[(tert-Butoxycarbonyl)amino]phenyl}acetic acidHCID 21264544(3aRS,7aRS)-7,7-Diphenylperhydro-4-isoindolone

Product 1

HCID 67915859HCID 67915859, compound

Sources & evidence

ORD record
ord-a69be877c4644969a1ef84be12cc5981
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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