Hydrochloric Acid → HCID 178483186, compound

HRID 2138155Notes

Reaction equation

HRID 2138155 reaction equation
[C:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)(=[O:20])[O:21][CH:22]1[CH:23]([n:46]2[c:47]3[n:48][c:49]([Cl:56])[n:50][c:51]([Cl:55])[c:52]3[n:53][cH:54]2)[O:24][CH:25]([CH2:36][O:37][C:38]([c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)=[O:45])[CH:26]1[O:27][C:28]([c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1)=[O:35].[CH3:2][N:3]([NH2:4])[CH2:5][CH2:6][c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1.[CH3:57][CH2:58][N:59]([CH2:60][CH3:61])[CH2:62][CH3:63].[ClH:1].[O:64]1[CH2:65][CH2:66][O:67][CH2:68][CH2:69]1>>[CH3:2][N:3]([NH:4][c:51]1[n:50][c:49]([Cl:56])[n:48][c:47]2[n:46]([CH:23]3[CH:22]([O:21][C:13]([c:14]4[cH:15][cH:16][cH:17][cH:18][cH:19]4)=[O:20])[CH:26]([O:27][C:28]([c:29]4[cH:30][cH:31][cH:32][cH:33][cH:34]4)=[O:35])[CH:25]([CH2:36][O:37][C:38]([c:39]4[cH:40][cH:41][cH:42][cH:43][cH:44]4)=[O:45])[O:24]3)[cH:54][n:53][c:52]21)[CH2:5][CH2:6][c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 8471TriethylamineHCID 312751,4-DioxaneHCID 19926386HCID 19926386, compoundHCID 73063998HCID 73063998, compound

Product 1

HCID 178483186HCID 178483186, compound

Sources & evidence

ORD record
ord-a249976ea8464b26b43b74d6a8563d0b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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