Acetate → HCID 12083033, compound

HRID 295932Notes

Reaction equation

HRID 295932 reaction equation
[Br:25][c:26]1[cH:27][c:28]2[c:29](=[O:45])[c:30]([C:40](=[O:41])[O:42][CH2:43][CH3:44])[cH:31][n:32]3[c:33]2[c:34]([cH:35]1)[CH2:36][C:37]3([CH3:38])[CH3:39].[C:60]([O-:61])(=[O:62])[CH3:63].[C:65]([O-:66])(=[O:67])[CH3:68].[CH2:20]([Li:21])[CH2:22][CH2:23][CH3:24].[CH2:46]([C:47]#[CH:48])[OH:49].[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[CH2:55]([NH:56][CH2:57][CH3:58])[CH3:59].[Cu:69]([I:70])[I:71].[Pd+2:64].[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1>>[c:26]1([C:48]#[C:47][CH2:46][OH:49])[cH:27][c:28]2[c:29](=[O:45])[c:30]([C:40](=[O:41])[O:42][CH2:43][CH3:44])[cH:31][n:32]3[c:33]2[c:34]([cH:35]1)[CH2:36][C:37]3([CH3:38])[CH3:39]

Participants

10

Reactant 9

HCID 175Acetate2×HCID 7859Propargyl alcoholHCID 8021DiethylamineHCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 83717Copper iodideHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 12083032ethyl 8-bromo-2,2-dimethyl-6-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinoline-5-carboxylateHCID 178418339Butyllithium

Product 1

HCID 12083033HCID 12083033, compound

Sources & evidence

ORD record
ord-3140a4abac4b402dbec0d89182e73559
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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