Benzene → HCID 70535275, compound

HRID 201878Notes

Reaction equation

HRID 201878 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][CH2:10][N:11]([c:14]3[cH:15][cH:16][c:17]([NH2:18])[cH:19][cH:20]3)[CH2:12][CH2:13]2)[cH:21][cH:22][c:23]1[O:24][CH3:25].[CH3:26][CH2:27][N:28]([CH2:29][CH3:30])[CH2:31][CH3:32].[CH3:33][O:34][CH:35]=[CH:36][C:37](=[O:38])[Cl:39].[cH:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][CH2:10][N:11]([c:14]3[cH:15][cH:16][c:17]([NH:18][C:37]([CH:36]=[CH:35][O:34][CH3:33])=[O:38])[cH:19][cH:20]3)[CH2:12][CH2:13]2)[cH:21][cH:22][c:23]1[O:24][CH3:25]

Participants

5

Reactant 4

HCID 241BenzeneHCID 8471TriethylamineHCID 20480569HCID 20480569, compoundHCID 53692984HCID 53692984, compound

Product 1

HCID 70535275HCID 70535275, compound

Sources & evidence

ORD record
ord-9f8fdd4cd33141619199d8f7869d493d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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