Methanol → HCID 178488568, compound

HRID 2317237Notes

Reaction equation

[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[cH:10][cH:11][c:12]([C:35]([F:36])([F:37])[F:38])[c:13]([NH:15][CH2:16][CH2:17][CH2:18][O:19][c:20]3[cH:21][c:22]4[c:26]([cH:27][cH:28]3)[CH:25]([CH2:29][C:30](=[O:31])[O:32][CH2:33][CH3:34])[CH2:24][CH2:23]4)[n:14]2)[cH:7][cH:8]1.[CH3:47][OH:48].[Li+:41].[OH-:40].[OH2:39]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[cH:10][cH:11][c:12]([C:35]([F:36])([F:37])[F:38])[c:13]([NH:15][CH2:16][CH2:17][CH2:18][O:19][c:20]3[cH:21][c:22]4[c:26]([cH:27][cH:28]3)[CH:25]([CH2:29][C:30](=[O:31])[OH:32])[CH2:24][CH2:23]4)[n:14]2)[cH:7][cH:8]1

Participants

Reactant 6

HCID 887Methanol

HCID 961Hydroxide

HCID 962Water

HCID 8028Tetrahydrofuran

HCID 28486Lithium ion

HCID 178470607ethyl 2-[5-[3-[[6-(4-methoxyphenyl)-3-(trifluoromethyl)-2-pyridinyl]amino]propoxy]-2,3-dihydro-1H-inden-1-yl]acetate

Product 1

HCID 178488568HCID 178488568, compound

Sources & evidence

ORD record: ord-890bb4f2ffdd49d2bf1814d932354f55
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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