Acetonitrile → 1-O-tert-butyl 2-O-(3-chloro-8-oxo-5,9,10,11-tetrahydronaphtho[3,2-c]isochromen-9-yl) 4-ethoxypyrrolidine-1,2-dicarboxylate

HRID 161090Notes

Reaction equation

HRID 161090 reaction equation
[Br:1][CH:2]1[C:3](=[O:21])[c:4]2[c:5]([cH:6][c:7]3[c:12]([cH:13]2)[O:11][CH2:10][c:9]2[c:8]-3[cH:17][cH:16][c:15]([Cl:18])[cH:14]2)[CH2:19][CH2:20]1.[C:22]([CH3:23])([CH3:24])([CH3:25])[O:26][C:27](=[O:28])[N:29]1[CH:30]([C:37](=[O:38])[OH:39])[CH2:31][CH:32]([O:34][CH2:35][CH3:36])[CH2:33]1.[CH3:49][C:50]#[N:51].[CH3:52][CH2:53][O:54][C:55]([CH3:56])=[O:57].[CH:40]([N:41]([CH2:42][CH3:43])[CH:44]([CH3:45])[CH3:46])([CH3:47])[CH3:48]>>[CH:2]1([O:39][C:37]([CH:30]2[N:29]([C:27]([O:26][C:22]([CH3:23])([CH3:24])[CH3:25])=[O:28])[CH2:33][CH:32]([O:34][CH2:35][CH3:36])[CH2:31]2)=[O:38])[C:3](=[O:21])[c:4]2[c:5]([cH:6][c:7]3[c:12]([cH:13]2)[O:11][CH2:10][c:9]2[c:8]-3[cH:17][cH:16][c:15]([Cl:18])[cH:14]2)[CH2:19][CH2:20]1

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 81531DiisopropylethylamineHCID 219058641-[(Tert-butoxy)carbonyl]-4-ethoxypyrrolidine-2-carboxylic acidHCID 696732929-bromo-3-chloro-10,11-dihydro-5H-dibenzo[c,g]chromen-8(9H)-one

Product 1

HCID 776907421-O-tert-butyl 2-O-(3-chloro-8-oxo-5,9,10,11-tetrahydronaphtho[3,2-c]isochromen-9-yl) 4-ethoxypyrrolidine-1,2-dicarboxylate

Sources & evidence

ORD record
ord-ea64e92490e840219636f5d222647263
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…