Dichloromethane → HCID 178445086, compound

HRID 313012Notes

Reaction equation

HRID 313012 reaction equation
[CH2:25]([CH2:26][CH2:27][CH2:28][CH:29]=[CH2:30])[O:31][C:32](=[O:33])[NH:34][CH:35]([C:36](=[O:37])[OH:38])[C:39]([CH3:40])([CH3:41])[CH3:42].[CH3:52][O:53][C:54]1([c:63]2[cH:64][cH:65][c:66](-[c:69]3[c:70]([CH:75]=[CH2:76])[cH:71][cH:72][cH:73][cH:74]3)[cH:67][cH:68]2)[CH2:55][CH:56]([C:59](=[O:60])[O:61][CH3:62])[NH:57][CH2:58]1.[CH:43]([N:44]([CH2:45][CH3:46])[CH:47]([CH3:48])[CH3:49])([CH3:50])[CH3:51].[Cl:77][CH2:78][Cl:79].[P-:1]([F:2])([F:3])([F:4])([F:5])([F:6])[F:7].[n:8]1([O:9][C:10]([N:11]([CH3:12])[CH3:13])=[N+:14]([CH3:15])[CH3:16])[c:17]2[n:18][cH:19][cH:20][cH:21][c:22]2[n:23][n:24]1>>[CH2:25]([CH2:26][CH2:27][CH2:28][CH:29]=[CH2:30])[O:31][C:32](=[O:33])[NH:34][CH:35]([C:36](=[O:38])[N:57]1[CH:56]([C:59](=[O:60])[O:61][CH3:62])[CH2:55][C:54]([O:53][CH3:52])([c:63]2[cH:64][cH:65][c:66](-[c:69]3[c:70]([CH:75]=[CH2:76])[cH:71][cH:72][cH:73][cH:74]3)[cH:67][cH:68]2)[CH2:58]1)[C:39]([CH3:40])([CH3:41])[CH3:42]

Participants

7

Reactant 6

HCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 67239006Methyl 4-[4-(2-ethenylphenyl)phenyl]-4-methoxypyrrolidine-2-carboxylateHCID 751131252-(Hex-5-enoxycarbonylamino)-3,3-dimethylbutanoic acid

Product 1

HCID 178445086HCID 178445086, compound

Sources & evidence

ORD record
ord-f906e632bc1b47e2bc418c0e18eaf841
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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