CID 465671

Chembl289000

Structural Information

Molecular Formula
C24H19N3O3
SMILES
C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)N3C=CN=C3)OCC(=O)NC4=CC=CC=C4
InChI
InChI=1S/C24H19N3O3/c28-23(26-19-9-5-2-6-10-19)16-30-22-12-11-20(27-14-13-25-17-27)15-21(22)24(29)18-7-3-1-4-8-18/h1-15,17H,16H2,(H,26,28)
InChIKey
HYYUUBOYXOPXEM-UHFFFAOYSA-N
Compound name
2-(2-benzoyl-4-imidazol-1-ylphenoxy)-N-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

397.14264 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 398.149916 193.7
[M+Na]+ 420.131858 198.5
[M-H]- 396.135364 203.6
[M+NH4]+ 415.176463 201.8
[M+K]+ 436.105798 192.8
[M+H-H2O]+ 380.139900 181.6
[M+HCOO]- 442.140841 215.0
[M+CH3COO]- 456.156491 202.5
[M+Na-2H]- 418.117306 195.5
[M]+ 397.14209142 194.0
[M]- 397.14318858 194.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.