Benzene → HCID 67859050, compound

HRID 1130967Notes

Reaction equation

HRID 1130967 reaction equation
[C:7]([CH3:8])(=[O:9])[O:10][C:11](=[O:12])[CH3:13].[CH2:14]([CH3:15])[O:16][c:17]1[cH:18][c:19]2[c:24]([cH:25][c:26]1[O:27][CH2:28][CH3:29])[C:23](=[C:30]([C:31]#[N:32])[S:33][CH2:34][CH:35]([CH2:36][N:37]1[CH2:38][CH2:39][O:40][CH2:41][CH2:42]1)[OH:43])[NH:22][CH2:21][CH2:20]2.[CH:44]([OH:45])([CH3:46])[CH3:47].[cH:1]1[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[C:7]([CH3:8])(=[O:9])[O:43][CH:35]([CH2:34][S:33][C:30](=[C:23]1[NH:22][CH2:21][CH2:20][c:19]2[cH:18][c:17]([O:16][CH2:14][CH3:15])[c:26]([O:27][CH2:28][CH3:29])[cH:25][c:24]21)[C:31]#[N:32])[CH2:36][N:37]1[CH2:38][CH2:39][O:40][CH2:41][CH2:42]1

Participants

5

Reactant 4

HCID 241BenzeneHCID 3776IsopropanolHCID 7918Acetic AnhydrideHCID 67859005HCID 67859005, compound

Product 1

HCID 67859050HCID 67859050, compound

Sources & evidence

ORD record
ord-0b0f515b97714afc86461ef7fc9dd9c3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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