Water → HCID 12087764, compound

HRID 2140097Notes

Reaction equation

HRID 2140097 reaction equation
[CH3:26][CH2:27][N:28]([CH2:29][CH3:30])[CH2:31][CH3:32].[Cl:33][c:34]1[c:35]([C:36](=[O:37])[Cl:38])[cH:39][c:40]([N+:43](=[O:44])[O-:45])[cH:41][cH:42]1.[Cl:6][c:7]1[c:8]([CH2:17][O:18][c:19]2[cH:20][cH:21][c:22]([NH2:23])[cH:24][cH:25]2)[n:9][cH:10][c:11]([C:13]([F:14])([F:15])[F:16])[cH:12]1.[O:1]1[CH2:2][CH2:3][CH2:4][CH2:5]1.[OH2:46]>>[Cl:6][c:7]1[c:8]([CH2:17][O:18][c:19]2[cH:20][cH:21][c:22]([NH:23][C:36]([c:35]3[c:34]([Cl:33])[cH:42][cH:41][c:40]([N+:43](=[O:44])[O-:45])[cH:39]3)=[O:37])[cH:24][cH:25]2)[n:9][cH:10][c:11]([C:13]([F:14])([F:15])[F:16])[cH:12]1

Participants

6

Reactant 5

HCID 962WaterHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 117637Benzoyl chloride, 2-chloro-5-nitro-HCID 21901883HCID 21901883, compound

Product 1

HCID 12087764HCID 12087764, compound

Sources & evidence

ORD record
ord-2ac5245a7fb64975b5491dca9f1d5e0d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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