3-Nitrobenzenesulfonyl chloride → HCID 178523340, compound

HRID 686892Notes

Reaction equation

HRID 686892 reaction equation
[N+:34](=[O:35])([O-:36])[c:37]1[cH:38][c:39]([S:43](=[O:44])(=[O:45])[Cl:46])[cH:40][cH:41][cH:42]1.[O-:27][C:28]([C:29]([F:30])([F:31])[F:32])=[O:33].[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:13]1[CH:12]([CH2:14][O:15][C:16](=[O:17])[NH:18][CH:19]([CH2:20][CH2:21][CH2:22][NH2:23])[C:24](=[O:25])[OH:26])[c:11]1[c:6]-2[cH:7][cH:8][cH:9][cH:10]1>>[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:13]1[CH:12]([CH2:14][O:15][C:16](=[O:17])[NH:18][CH:19]([CH2:20][CH2:21][CH2:22][NH:23][S:43]([c:39]1[cH:38][c:37]([N+:34](=[O:35])[O-:36])[cH:42][cH:41][cH:40]1)(=[O:44])=[O:45])[C:24](=[O:25])[OH:26])[c:11]1[c:6]-2[cH:7][cH:8][cH:9][cH:10]1

Participants

4

Reactant 3

HCID 84763-Nitrobenzenesulfonyl chlorideHCID 84468TrifluoroacetateHCID 18423820HCID 18423820, compound

Product 1

HCID 178523340HCID 178523340, compound

Sources & evidence

ORD record
ord-6dee582843d243d3be905ed20f68d8f5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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