CID 2753

Cilostamide

Structural Information

Molecular Formula
C20H26N2O3
SMILES
CN(C1CCCCC1)C(=O)CCCOC2=CC3=C(C=C2)NC(=O)C=C3
InChI
InChI=1S/C20H26N2O3/c1-22(16-6-3-2-4-7-16)20(24)8-5-13-25-17-10-11-18-15(14-17)9-12-19(23)21-18/h9-12,14,16H,2-8,13H2,1H3,(H,21,23)
InChIKey
UIAYVIIHMORPSJ-UHFFFAOYSA-N
Compound name
N-cyclohexyl-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

198
References

4233
Patents

342.19434 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.20162 182.1
[M+Na]+ 365.18356 193.2
[M+NH4]+ 360.22816 189.0
[M+K]+ 381.15750 186.2
[M-H]- 341.18706 185.7
[M+Na-2H]- 363.16901 187.6
[M]+ 342.19379 184.5
[M]- 342.19489 184.5
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

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