Hydrochloric Acid → 1-Aminomethyl-6,8-dimethoxy-isoquinoline-4-carboxylic acid benzyl-(2-dimethylamino-ethyl)-amide

HRID 2326399Notes

Reaction equation

HRID 2326399 reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][CH2:8][c:9]1[n:10][cH:11][c:12]([C:23]([N:24]([CH2:25][CH2:26][N:27]([CH3:28])[CH3:29])[CH2:30][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)=[O:37])[c:13]2[cH:14][c:15]([O:21][CH3:22])[cH:16][c:17]([O:19][CH3:20])[c:18]12)([CH3:5])([CH3:6])[CH3:38].[CH3:40][CH2:41][O:42][C:43]([CH3:44])=[O:45].[ClH:39]>>[NH2:7][CH2:8][c:9]1[n:10][cH:11][c:12]([C:23]([N:24]([CH2:25][CH2:26][N:27]([CH3:28])[CH3:29])[CH2:30][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)=[O:37])[c:13]2[cH:14][c:15]([O:21][CH3:22])[cH:16][c:17]([O:19][CH3:20])[c:18]12

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 8857Ethyl AcetateHCID 68613386{4-[Benzyl-(2-dimethylamino-ethyl)-carbamoyl]-6,8-dimethoxy-isoquinolin-1-ylmethyl}-carbamic acid tert-butyl ester

Product 1

HCID 468469411-Aminomethyl-6,8-dimethoxy-isoquinoline-4-carboxylic acid benzyl-(2-dimethylamino-ethyl)-amide

Sources & evidence

ORD record
ord-15fac6deb70f482897c53fee7ca551c0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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