Acetic Acid → HCID 19837954, compound

HRID 1555139Notes

Reaction equation

HRID 1555139 reaction equation
[CH3:33][C:34](=[O:35])[OH:36].[Cl:1][c:2]1[c:3]([C:9]([CH2:10][n:11]2[n:12][cH:13][n:14][cH:15]2)([CH2:16][N:17]2[CH2:18][CH2:19][N:20]([c:23]3[cH:24][cH:25][c:26]([N+:29]([O-:30])=[O:31])[cH:27][cH:28]3)[CH2:21][CH2:22]2)[OH:32])[cH:4][cH:5][c:6]([Cl:8])[cH:7]1>>[Cl:1][c:2]1[c:3]([C:9]([CH2:10][n:11]2[n:12][cH:13][n:14][cH:15]2)([CH2:16][N:17]2[CH2:18][CH2:19][N:20]([c:23]3[cH:24][cH:25][c:26]([NH2:29])[cH:27][cH:28]3)[CH2:21][CH2:22]2)[OH:32])[cH:4][cH:5][c:6]([Cl:8])[cH:7]1

Participants

3

Reactant 2

HCID 176Acetic AcidHCID 19837955HCID 19837955, compound

Product 1

HCID 19837954HCID 19837954, compound

Sources & evidence

ORD record
ord-bf05d28b19324b8981694da1c70c3c88
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…