Benzene → HCID 68868816, compound

HRID 1131555Notes

Reaction equation

HRID 1131555 reaction equation
[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[N:8]1[CH2:9][CH2:10][NH:11][CH2:12][CH2:13]1.[O:14]=[C:15]([CH2:16][C:17]#[N:18])[c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1.[cH:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[N:8]1[CH2:9][CH2:10][N:11]([C:15](=[CH:16][C:17]#[N:18])[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[CH2:12][CH2:13]1

Participants

4

Reactant 3

HCID 241BenzeneHCID 64799BenzoylacetonitrileHCID 143452tert-Butyl piperazine-1-carboxylate

Product 1

HCID 68868816HCID 68868816, compound

Sources & evidence

ORD record
ord-b34b00db94c146838602562d4de960e9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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