Ethyl propiolate → HCID 178471834, compound

HRID 1202546Notes

Reaction equation

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

Participants

Reactant 2

HCID 12182Ethyl propiolate

HCID 98655067-(1,2,3,4,4a,5,7,7a-Octahydropyrrolo[3,4-b]pyridin-6-yl)-8-cyano-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid

Product 1

HCID 178471834HCID 178471834, compound

Sources & evidence

ORD record: ord-c998924a95f24f67aec0e03a0c4cc4f5
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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