Calcium Cation → 4-morpholino-N-(4-nitrophenoxycarbonyl)aniline

HRID 1206967Notes

Reaction equation

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

Participants

Reactant 6

HCID 271Calcium Cation

HCID 887Methanol

HCID 6344Dichloromethane2×

HCID 19660Carbonate Ion

HCID 75655Benzenamine, 4-(4-morpholinyl)-

HCID 821294-Nitrophenyl chloroformate

Product 1

HCID 227075274-morpholino-N-(4-nitrophenoxycarbonyl)aniline

Sources & evidence

ORD record: ord-6b75acb4fef44b0bb9dbe79c8dd00ca4
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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