Benzoic Acid → HCID 10223647, compound

HRID 2343661Notes

Reaction equation

HRID 2343661 reaction equation
[CH2:1]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:33]1)[O:8][C:9](=[O:2])[NH:10][CH2:11][CH:12]1[CH2:13][CH:14]([n:18]2[c:19](=[O:32])[c:20]3[c:21]([c:22]4[n:23][cH:24][cH:25][cH:26][c:27]24)[n:28][o:29][c:30]3[CH3:31])[CH2:15][CH2:16][CH2:17]1.[CH3:71][N:72]([CH3:73])[CH:74]=[O:75].[CH:59]([N:60]([CH2:61][CH3:62])[CH:63]([CH3:64])[CH3:65])([CH3:66])[CH3:67].[Cl:68][CH2:69][Cl:70].[ClH:48].[I:34][Si:35]([CH3:36])([CH3:37])[CH3:38].[OH:39][C:40](=[O:41])[c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[OH:49][n:50]1[c:51]2[n:52][cH:53][cH:54][cH:55][c:56]2[n:57][n:58]1>>[O:8]=[C:9]([NH:10][CH2:11][CH:12]1[CH2:13][CH:14]([n:18]2[c:19](=[O:32])[c:20]3[c:21]([c:22]4[n:23][cH:24][cH:25][cH:26][c:27]24)[n:28][o:29][c:30]3[CH3:31])[CH2:15][CH2:16][CH2:17]1)[c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1

Participants

9

Reactant 8

HCID 243Benzoic AcidHCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 81531DiisopropylethylamineHCID 85247Trimethylsilyl iodideHCID 181649HOAtHCID 69652693HCID 69652693, compound

Product 1

HCID 10223647HCID 10223647, compound

Sources & evidence

ORD record
ord-82d0dd1ddd8e4b25958edad506e08674
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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