Calcium Cation → HCID 58770016, compound

HRID 192234Notes

Reaction equation

HRID 192234 reaction equation
[C:13](=[O:14])([O-:15])[O-:16].[CH3:34][OH:35].[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[CH:1]1([O:5][c:6]2[cH:7][cH:8][c:9]([NH2:12])[cH:10][n:11]2)[CH2:2][CH2:3][CH2:4]1.[Ca+2:17].[Cl:18][C:19](=[O:20])[O:21][c:22]1[cH:23][cH:24][c:25]([N+:28](=[O:29])[O-:30])[cH:26][cH:27]1.[Cl:31][CH2:32][Cl:33]>>[CH:1]1([O:5][c:6]2[cH:7][cH:8][c:9]([NH:12][C:19](=[O:20])[O:21][c:22]3[cH:23][cH:24][c:25]([N+:28](=[O:29])[O-:30])[cH:26][cH:27]3)[cH:10][n:11]2)[CH2:2][CH2:3][CH2:4]1

Participants

8

Reactant 7

HCID 271Calcium CationHCID 887MethanolHCID 1140TolueneHCID 6344DichloromethaneHCID 19660Carbonate IonHCID 821294-Nitrophenyl chloroformateHCID 587700226-Cyclobutoxypyridin-3-amine

Product 1

HCID 58770016HCID 58770016, compound

Sources & evidence

ORD record
ord-953fa28cba534086b6df0b078b3c15f2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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