Ammonium → HCID 66826305, compound

HRID 1542941Notes

Reaction equation

HRID 1542941 reaction equation
[C:1](=[O:2])([CH3:3])[O:4][c:5]1[cH:6][c:7]2[c:8]([NH:26][c:27]3[cH:28][c:29]4[cH:30][n:31][n:32]([C:36](=[O:37])[O:38][C:39]([CH3:40])([CH3:41])[CH3:42])[c:33]4[cH:34][cH:35]3)[n:9][c:10](-[c:17]3[cH:18][c:19]([N+:23](=[O:24])[O-:25])[cH:20][cH:21][cH:22]3)[n:11][c:12]2[cH:13][c:14]1[O:15][CH3:16].[CH3:45][OH:46].[NH4+:44].[OH-:43]>>[OH:4][c:5]1[cH:6][c:7]2[c:8]([NH:26][c:27]3[cH:28][c:29]4[cH:30][n:31][n:32]([C:36](=[O:37])[O:38][C:39]([CH3:40])([CH3:41])[CH3:42])[c:33]4[cH:34][cH:35]3)[n:9][c:10](-[c:17]3[cH:18][c:19]([N+:23](=[O:24])[O-:25])[cH:20][cH:21][cH:22]3)[n:11][c:12]2[cH:13][c:14]1[O:15][CH3:16]

Participants

5

Reactant 4

HCID 223AmmoniumHCID 887MethanolHCID 961HydroxideHCID 66826043tert-butyl 5-(6-acetoxy-7-methoxy-2-(3-nitrophenyl)-quinazolin-4-ylamino)-1H-indazole-1-carboxylate

Product 1

HCID 66826305HCID 66826305, compound

Sources & evidence

ORD record
ord-3754b35d49594b4aae75e79ba3d162ca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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