Ethanol → 7-Methoxy-1,3,4,5-tetrahydro-benzo[e][1,4]diazepin-2-one

HRID 1133773Notes

Reaction equation

HRID 1133773 reaction equation
[CH2:1]([O:2][C:3](=[O:4])[N:11]1[CH2:12][C:13](=[O:24])[NH:14][c:15]2[c:16]([cH:18][c:19]([O:22][CH3:23])[cH:20][cH:21]2)[CH2:17]1)[c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1.[CH3:25][CH2:26][O:27][C:28](=[O:29])[CH3:30].[CH3:31][CH2:32][OH:33]>>[NH:11]1[CH2:12][C:13](=[O:24])[NH:14][c:15]2[c:16]([cH:18][c:19]([O:22][CH3:23])[cH:20][cH:21]2)[CH2:17]1

Participants

4

Reactant 3

HCID 702EthanolHCID 8857Ethyl AcetateHCID 672637677-Methoxy-2-oxo-1,2,3,5-tetrahydro-benzo[e][1,4]diazepine-4-carboxylic acid benzyl ester

Product 1

HCID 672641827-Methoxy-1,3,4,5-tetrahydro-benzo[e][1,4]diazepin-2-one

Sources & evidence

ORD record
ord-99c931e64ae34ebfa634b06283cb6dcc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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