Hydrochloric Acid → HCID 68501233, compound

HRID 684952Notes

Reaction equation

HRID 684952 reaction equation
[C:1](=[O:2])([OH:3])[c:4]1[cH:5][cH:6][c:7]([CH:10]2[CH:11]([O:26][CH2:27][c:28]3[cH:29][cH:30][c:31]4[c:32]([cH:42]3)[N:33]([CH2:37][CH2:38][CH2:39][O:40][CH3:41])[CH2:34][CH2:35][O:36]4)[CH2:12][N:13]([C:16](=[O:17])[O:18][CH2:19][c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH2:14][CH2:15]2)[cH:8][cH:9]1.[CH3:54][N:55]([CH3:56])[CH2:57][CH2:58][CH2:59][N:60]=[C:61]=[N:62][CH2:63][CH3:64].[CH3:66][N:67]([CH3:68])[CH:69]=[O:70].[CH3:71][N:72]([CH3:73])[c:74]1[cH:75][cH:76][n:77][cH:78][cH:79]1.[ClH:53].[O:43]([c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1)[CH2:50][CH2:51][NH2:52].[OH2:65]>>[C:1](=[O:2])([c:4]1[cH:5][cH:6][c:7]([CH:10]2[CH:11]([O:26][CH2:27][c:28]3[cH:29][cH:30][c:31]4[c:32]([cH:42]3)[N:33]([CH2:37][CH2:38][CH2:39][O:40][CH3:41])[CH2:34][CH2:35][O:36]4)[CH2:12][N:13]([C:16](=[O:17])[O:18][CH2:19][c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH2:14][CH2:15]2)[cH:8][cH:9]1)[NH:52][CH2:51][CH2:50][O:43][c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 962WaterHCID 6228DimethylformamideHCID 142844-(Dimethylamino)pyridineHCID 156512-PhenoxyethanamineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 68497868benzyl 4-(4-carboxyphenyl)-3-[4-(3-methoxypropyl)-3,4-dihydro-2H-benzo[1,4]oxazin-6-ylmethoxy]piperidine-1-carboxylate

Product 1

HCID 68501233HCID 68501233, compound

Sources & evidence

ORD record
ord-5f7f5110c4ba4278b6896400ed935dbd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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