Isopropanol → HCID 14373548, compound

HRID 1543199Notes

Reaction equation

HRID 1543199 reaction equation
[C:27]12([C:37](=[O:38])[Cl:39])[CH2:28][CH:29]3[CH2:30][CH:31]([CH2:32][CH:33]([CH2:34]1)[CH2:35]3)[CH2:36]2.[CH:18]([N:19]([CH:20]([CH3:21])[CH3:22])[CH2:23][CH3:24])([CH3:25])[CH3:26].[CH:40]([OH:41])([CH3:42])[CH3:43].[Cl:44][CH2:45][Cl:46].[OH:1][CH2:2][CH2:3][N:4]1[CH2:5][CH2:6][N:7]([c:10]2[c:11]([C:16]#[N:17])[cH:12][cH:13][cH:14][cH:15]2)[CH2:8][CH2:9]1>>[O:1]([CH2:2][CH2:3][N:4]1[CH2:5][CH2:6][N:7]([c:10]2[c:11]([C:16]#[N:17])[cH:12][cH:13][cH:14][cH:15]2)[CH2:8][CH2:9]1)[C:37]([C:27]12[CH2:28][CH:29]3[CH2:30][CH:31]([CH2:32][CH:33]([CH2:34]1)[CH2:35]3)[CH2:36]2)=[O:38]

Participants

6

Sources & evidence

ORD record
ord-ceb4c143958d4284b9c60f73c7d1f67a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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