Benzoic Acid → HCID 69058691, compound

HRID 1131467Notes

Reaction equation

HRID 1131467 reaction equation
[CH2:31]1[CH2:32][CH2:33][CH:34]([N:35]=[C:36]=[N:37][CH:38]2[CH2:39][CH2:40][CH2:41][CH2:42][CH2:43]2)[CH2:44][CH2:45]1.[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:13]([c:14]([CH3:17])[c:15]1[CH3:16])[N:12]([CH2:18][CH2:19][CH2:20][NH2:21])[CH2:11][C:7]1([CH2:6]2)[CH2:8][CH2:9][CH2:10]1.[CH3:49][N:50]([CH3:51])[c:52]1[cH:53][cH:54][n:55][cH:56][cH:57]1.[Cl:46][CH2:47][Cl:48].[OH:22][C:23](=[O:24])[c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:13]([c:14]([CH3:17])[c:15]1[CH3:16])[N:12]([CH2:18][CH2:19][CH2:20][NH:21][C:23](=[O:22])[c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)[CH2:11][C:7]1([CH2:6]2)[CH2:8][CH2:9][CH2:10]1

Participants

6

Reactant 5

HCID 243Benzoic AcidHCID 6344DichloromethaneHCID 10868DicyclohexylcarbodiimideHCID 142844-(Dimethylamino)pyridineHCID 69055179HCID 69055179, compound

Product 1

HCID 69058691HCID 69058691, compound

Sources & evidence

ORD record
ord-3c15ec78e5294c44935d9e474d42b5ee
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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