Ethyl Acetate → 4-(5-Cyano-pent-1-ynyl)-3-methoxy-benzonitrile

HRID 1225888Notes

Reaction equation

HRID 1225888 reaction equation
[C:1](#[N:2])[c:3]1[cH:4][c:5]([O:19][CH3:20])[c:6]([O:9][S:10]([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)(=[O:17])=[O:18])[cH:7][cH:8]1.[C:21]([CH2:22][CH2:23][CH2:24][C:25]#[CH:26])#[N:27].[CH3:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH3:34].[CH3:35][CH2:36][O:37][C:38]([CH3:39])=[O:40]>>[C:1](#[N:2])[c:3]1[cH:4][c:5]([O:19][CH3:20])[c:6]([C:26]#[C:25][CH2:24][CH2:23][CH2:22][C:21]#[N:27])[cH:7][cH:8]1

Participants

5

Sources & evidence

ORD record
ord-e945f704a6404681b4b8e20a31ae462b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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