Sodium ion → HCID 178468918, compound

HRID 701022Notes

Reaction equation

HRID 701022 reaction equation
[C:1]12([O:11][CH2:12][c:13]3[cH:14][c:15]([OH:25])[n:16](-[c:18]4[c:19]([CH3:24])[cH:20][cH:21][cH:22][cH:23]4)[n:17]3)[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2.[CH2:28]([CH3:29])[O:30][C:31](=[O:32])[c:33]1[cH:34][c:35]([N:39]=[C:40]=[O:41])[cH:36][cH:37][cH:38]1.[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[H-:26].[Na+:27]>>[C:1]12([O:11][CH2:12][c:13]3[c:14]([C:40]([NH:39][c:35]4[cH:34][c:33]([C:31]([O:30][CH2:28][CH3:29])=[O:32])[cH:38][cH:37][cH:36]4)=[O:41])[c:15]([OH:25])[n:16](-[c:18]4[c:19]([CH3:24])[cH:20][cH:21][cH:22][cH:23]4)[n:17]3)[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2

Participants

6

Reactant 5

HCID 923Sodium ionHCID 8028TetrahydrofuranHCID 166653HydrideHCID 589806Ethyl 3-isocyanatobenzoateHCID 178424338HCID 178424338, compound

Product 1

HCID 178468918HCID 178468918, compound

Sources & evidence

ORD record
ord-2338c7160c5f47509a4affc1164c4662
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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