Toluene → HCID 11293419, compound

HRID 695587Notes

Reaction equation

HRID 695587 reaction equation
[CH2:8]([CH3:9])[NH:10][CH2:11][CH2:12][CH2:13][NH:14][c:15]1[n:16][cH:17][cH:18][c:19]2[c:20]([CH3:32])[c:21]3[c:22]([cH:23][c:24]12)[c:25]1[c:26]([nH:27]3)[cH:28][cH:29][n:30][cH:31]1.[CH3:33][c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1.[O:1]=[C:2]1[CH2:3][CH2:4][C:5](=[O:6])[O:7]1>>[O:1]=[C:2]([CH2:3][CH2:4][C:5](=[O:6])[N:10]([CH2:8][CH3:9])[CH2:11][CH2:12][CH2:13][NH:14][c:15]1[n:16][cH:17][cH:18][c:19]2[c:20]([CH3:32])[c:21]3[c:22]([cH:23][c:24]12)[c:25]1[c:26]([nH:27]3)[cH:28][cH:29][n:30][cH:31]1)[OH:7]

Participants

4

Sources & evidence

ORD record
ord-79741282ccec4c1e966e1342a1d5ccbd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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