Benzene → HCID 21444477, compound

HRID 86709Notes

Reaction equation

HRID 86709 reaction equation
[CH3:33][C:34]([Cl:35])=[O:36].[Na+:27].[Na+:28].[O-:29][C:30](=[O:31])[O-:32].[c:1]1([C:7]2([OH:26])[CH2:8][CH2:9][N:10]([CH2:13][CH:14]3[C:15](=[O:25])[c:16]4[cH:17][cH:18][c:19]([NH2:24])[cH:20][c:21]4[CH2:22][CH2:23]3)[CH2:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[cH:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[c:1]1([C:7]2([OH:26])[CH2:8][CH2:9][N:10]([CH2:13][CH:14]3[C:15](=[O:25])[c:16]4[cH:17][cH:18][c:19]([NH:24][C:34]([CH3:33])=[O:36])[cH:20][c:21]4[CH2:22][CH2:23]3)[CH2:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 241BenzeneHCID 923Sodium ion2×HCID 6367Acetyl chlorideHCID 19660Carbonate IonHCID 21444476HCID 21444476, compound

Product 1

HCID 21444477HCID 21444477, compound

Sources & evidence

ORD record
ord-6b827baea7b240759ff5132c52a0ec38
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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