Hydrochloric Acid → HCID 54498156, compound

HRID 1117944Notes

Reaction equation

HRID 1117944 reaction equation
[C:1]([CH3:3])([CH3:4])([O:5][C:6](=[O:2])[N:8]1[CH2:9][CH:10]([CH2:24][Cl:25])[c:11]2[c:12]3[c:13]([c:14]([N+:17](=[O:18])[O-:19])[cH:15][c:16]21)[cH:20][cH:21][cH:22][cH:23]3)[CH3:7].[C:38]([CH3:39])(=[O:40])[NH:41][c:42]1[cH:43][c:44]([CH:45]=[CH:46][C:47]([OH:48])=[O:49])[cH:50][cH:51][cH:52]1.[CH3:26][CH2:27][N:28]=[C:29]=[N:30][CH2:31][CH2:32][CH2:33][N:34]([CH3:35])[CH3:36].[ClH:37]>>[O:5]=[C:6]([N:8]1[CH2:9][CH:10]([CH2:24][Cl:25])[c:11]2[c:12]3[c:13]([c:14]([N+:17](=[O:18])[O-:19])[cH:15][c:16]21)[cH:20][cH:21][cH:22][cH:23]3)[CH:46]=[CH:45][c:44]1[cH:43][c:42]([NH:41][C:38]([CH3:39])=[O:40])[cH:52][cH:51][cH:50]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 153804133-(tert-butyloxycarbonyl)-1-chloromethyl-5-nitro-1,2-dihydro-3H-benz[e]indoleHCID 534395323-(3-Acetamidophenyl)prop-2-enoic acid

Product 1

HCID 54498156HCID 54498156, compound

Sources & evidence

ORD record
ord-942282c301d24af7aaa302011729b8a9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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