Hydrochloric Acid → HCID 19045475, compound

HRID 114930Notes

Reaction equation

HRID 114930 reaction equation
[CH3:2][O:3][c:4]1[cH:5][c:6]2[c:11]([cH:12][c:13]1[O:14][CH3:15])[C:10]1([NH:9][CH2:8][C:7]2=[O:32])[CH2:16][CH2:17][N:18]([CH2:21][CH2:22][c:23]2[cH:24][cH:25][c:26]([N+:29](=[O:30])[O-:31])[cH:27][cH:28]2)[CH2:19][CH2:20]1.[CH3:44][CH2:45][OH:46].[ClH:1].[N+:33](=[O:34])([O-:35])[c:36]1[cH:37][cH:38][c:39]([CH2:40][Br:41])[cH:42][cH:43]1>>[CH3:2][O:3][c:4]1[cH:5][c:6]2[c:11]([cH:12][c:13]1[O:14][CH3:15])[C:10]1([N:9]([CH2:40][c:39]3[cH:38][cH:37][c:36]([N+:33](=[O:34])[O-:35])[cH:43][cH:42]3)[CH2:8][C:7]2=[O:32])[CH2:16][CH2:17][N:18]([CH2:21][CH2:22][c:23]2[cH:24][cH:25][c:26]([N+:29](=[O:30])[O-:31])[cH:27][cH:28]2)[CH2:19][CH2:20]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 702EthanolHCID 660114-Nitrobenzyl bromideHCID 19045392HCID 19045392, compound

Product 1

HCID 19045475HCID 19045475, compound

Sources & evidence

ORD record
ord-08964185758d4bb1bbbb1ece9fb68ada
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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