Triethylamine → HCID 178525271, compound

HRID 668802Notes

Reaction equation

HRID 668802 reaction equation
[C:14]([c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1)(=[O:21])[O:22][CH:23]1[CH:24]([n:47]2[c:48]3[n:49][c:50]([Cl:57])[n:51][c:52]([Cl:56])[c:53]3[n:54][cH:55]2)[O:25][CH:26]([CH2:37][O:38][C:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)=[O:46])[CH:27]1[O:28][C:29]([c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)=[O:36].[CH3:58][CH2:59][N:60]([CH2:61][CH3:62])[CH2:63][CH3:64].[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]1[CH:9]([NH2:13])[CH2:10][CH2:11][CH2:12]1.[O:65]1[CH2:66][CH2:67][O:68][CH2:69][CH2:70]1>>[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]1[CH:9]([NH:13][c:52]2[n:51][c:50]([Cl:57])[n:49][c:48]3[n:47]([CH:24]4[CH:23]([O:22][C:14]([c:15]5[cH:16][cH:17][cH:18][cH:19][cH:20]5)=[O:21])[CH:27]([O:28][C:29]([c:30]5[cH:31][cH:32][cH:33][cH:34][cH:35]5)=[O:36])[CH:26]([CH2:37][O:38][C:39]([c:40]5[cH:41][cH:42][cH:43][cH:44][cH:45]5)=[O:46])[O:25]4)[cH:55][n:54][c:53]32)[CH2:10][CH2:11][CH2:12]1

Participants

5

Reactant 4

HCID 8471TriethylamineHCID 312751,4-DioxaneHCID 16785981HCID 16785981, compoundHCID 73063998HCID 73063998, compound

Product 1

HCID 178525271HCID 178525271, compound

Sources & evidence

ORD record
ord-af1c0e84265d49a1a13000923df38148
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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