Acetonitrile → HCID 13489022, compound

HRID 2145430Notes

Reaction equation

HRID 2145430 reaction equation
[Br:27][CH2:28][C:29](=[O:30])[O:31][CH2:32][c:33]1[cH:34][cH:35][c:36]([N+:39](=[O:40])[O-:41])[cH:37][cH:38]1.[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]1[C:10](=[O:19])[N:11]([OH:18])[CH:12]1[CH2:13][O:14][C:15]([NH2:16])=[O:17].[CH3:20][CH2:21][N:22]([CH2:23][CH3:24])[CH2:25][CH3:26].[CH3:42][C:43]#[N:44]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]1[C:10](=[O:19])[N:11]([O:18][CH2:28][C:29](=[O:30])[O:31][CH2:32][c:33]2[cH:34][cH:35][c:36]([N+:39](=[O:40])[O-:41])[cH:37][cH:38]2)[CH:12]1[CH2:13][O:14][C:15]([NH2:16])=[O:17]

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 70153214-Nitrobenzyl bromoacetateHCID 13489001HCID 13489001, compound

Product 1

HCID 13489022HCID 13489022, compound

Sources & evidence

ORD record
ord-012fb1f3414a46419096461fbba5151d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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