Calcium Cation → HCID 15072476, compound

HRID 151396Notes

Reaction equation

HRID 151396 reaction equation
[CH3:21][CH:22]1[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]1.[CH3:33][CH2:34][OH:35].[Ca+2:28].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[c:6]2[c:7]([Cl:13])[cH:8][c:9]([Cl:12])[cH:10][cH:11]2)[cH:14][c:15]([N+:18](=[O:19])[O-:20])[cH:16][cH:17]1.[O-:29][C:30](=[O:31])[O-:32]>>[c:2]1([N:25]2[CH2:24][CH2:23][CH:22]([CH3:21])[CH2:27][CH2:26]2)[c:3]([C:4](=[O:5])[c:6]2[c:7]([Cl:13])[cH:8][c:9]([Cl:12])[cH:10][cH:11]2)[cH:14][c:15]([N+:18](=[O:19])[O-:20])[cH:16][cH:17]1

Participants

6

Reactant 5

HCID 271Calcium CationHCID 702EthanolHCID 19660Carbonate IonHCID 693814-MethylpiperidineHCID 15072475(2-Chloro-5-nitrophenyl)(2,4-dichlorophenyl)methanone

Product 1

HCID 15072476HCID 15072476, compound

Sources & evidence

ORD record
ord-79331c57e89140489f4d68f1924b6faf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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