Acetic Acid → HCID 69229536, compound

HRID 98901Notes

Reaction equation

HRID 98901 reaction equation
[C:1]1(=[O:21])[c:2]2[c:3]([cH:17][cH:18][cH:19][cH:20]2)[C:4](=[O:16])[N:5]1[CH2:6][CH2:7][c:8]1[c:9]([CH:10]=[O:11])[cH:12][cH:13][cH:14][cH:15]1.[CH2:30]([NH2:31])[CH2:32][CH2:33][CH3:34].[CH3:26][C:27](=[O:28])[OH:29].[CH3:42][OH:43].[CH:35]([O:36][CH3:37])([O:38][CH3:39])[O:40][CH3:41].[N+:22](=[O:23])([O-:24])[CH3:25]>>[C:1]1(=[O:21])[c:2]2[c:3]([cH:17][cH:18][cH:19][cH:20]2)[C:4](=[O:16])[N:5]1[CH2:6][CH2:7][c:8]1[c:9]([CH:10]=[CH:25][N+:22](=[O:23])[O-:24])[cH:12][cH:13][cH:14][cH:15]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 887MethanolHCID 6375NitromethaneHCID 8007ButylamineHCID 9005Trimethyl orthoformateHCID 114714792-(2'-Phthalimidoethyl) benzaldehyde

Product 1

HCID 69229536HCID 69229536, compound

Sources & evidence

ORD record
ord-6b887dadb6984b99af8623f75bb0a82e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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