Sodium ion → HCID 68503653, compound

HRID 2147158

Reaction equation

HRID 2147158 reaction equation
[CH3:53][C:54]([CH3:55])([O-:56])[CH3:57].[CH3:59][c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1.[Cl:44][c:45]1[n:46][cH:47][n:48][cH:49][c:50]1[O:51][CH3:52].[NH2:1][CH2:2][CH2:3][CH2:4][CH2:5][O:6][c:7]1[cH:8][cH:9][c:10]([CH:13]2[CH:14]([O:26][CH2:27][c:28]3[cH:29][cH:30][c:31]4[c:36]([cH:37]3)[N:35]([CH2:38][CH2:39][CH2:40][O:41][CH3:42])[C:34](=[O:43])[CH2:33][CH2:32]4)[CH2:15][N:16]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH2:17][CH2:18]2)[cH:11][cH:12]1.[Na+:58]>>[NH:1]([CH2:2][CH2:3][CH2:4][CH2:5][O:6][c:7]1[cH:8][cH:9][c:10]([CH:13]2[CH:14]([O:26][CH2:27][c:28]3[cH:29][cH:30][c:31]4[c:36]([cH:37]3)[N:35]([CH2:38][CH2:39][CH2:40][O:41][CH3:42])[C:34](=[O:43])[CH2:33][CH2:32]4)[CH2:15][N:16]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH2:17][CH2:18]2)[cH:11][cH:12]1)[c:45]1[n:46][cH:47][n:48][cH:49][c:50]1[O:51][CH3:52]

Participants

6

Reactant 5

HCID 923Sodium ionHCID 1140TolueneHCID 45749132-Methylpropan-2-olateHCID 110080394-Chloro-5-methoxypyrimidineHCID 68501063Tert-butyl 4-[4-(4-aminobutoxy)phenyl]-3-[1-(3-methoxypropyl)-2-oxo-1,2,3,4-tetrahydroquinolin-7-ylmethoxy]piperidine-1-carboxylate

Product 1

HCID 68503653HCID 68503653, compound

Sources & evidence

ORD record
ord-02c7efe7a1ac4794b997e49584b6e23f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Linked notes

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