Sodium ion → HCID 178505132, compound

HRID 89615Notes

Reaction equation

HRID 89615 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH2:6][N:7]([S:8](=[O:9])(=[O:10])[CH3:11])[c:12]1[cH:13][cH:14][c:15]([NH:18][C:19]([c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)=[C:26]2[C:27](=[O:38])[NH:28][c:29]3[cH:30][cH:31][c:32]([N+:35](=[O:36])[O-:37])[cH:33][c:34]32)[cH:16][cH:17]1.[Na+:40].[O:41]1[CH2:42][CH2:43][O:44][CH2:45][CH2:46]1.[OH-:39]>>[O:3]=[C:4]([OH:5])[CH2:6][N:7]([S:8](=[O:9])(=[O:10])[CH3:11])[c:12]1[cH:13][cH:14][c:15]([NH:18][C:19]([c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)=[C:26]2[C:27](=[O:38])[NH:28][c:29]3[cH:30][cH:31][c:32]([N+:35](=[O:36])[O-:37])[cH:33][c:34]32)[cH:16][cH:17]1

Participants

5

Reactant 4

HCID 923Sodium ionHCID 961HydroxideHCID 312751,4-DioxaneHCID 178472671ethyl 2-[N-methylsulfonyl-4-[[(5-nitro-2-oxo-1H-indol-3-ylidene)-phenylmethyl]amino]anilino]acetate

Product 1

HCID 178505132HCID 178505132, compound

Sources & evidence

ORD record
ord-70b6f163349b49779b1ef02b1a7f8559
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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