CID 508748

Benzamide, n-[2-[[[1-[(4-chlorophenyl)methyl]-3-piperidinyl]methyl]amino]-2-oxoethyl]-3-(trifluoromethoxy)-

Structural Information

Molecular Formula
C23H25ClF3N3O3
SMILES
C1CC(CN(C1)CC2=CC=C(C=C2)Cl)CNC(=O)CNC(=O)C3=CC(=CC=C3)OC(F)(F)F
InChI
InChI=1S/C23H25ClF3N3O3/c24-19-8-6-16(7-9-19)14-30-10-2-3-17(15-30)12-28-21(31)13-29-22(32)18-4-1-5-20(11-18)33-23(25,26)27/h1,4-9,11,17H,2-3,10,12-15H2,(H,28,31)(H,29,32)
InChIKey
DSPAZXHEZUEKBP-UHFFFAOYSA-N
Compound name
N-[2-[[1-[(4-chlorophenyl)methyl]piperidin-3-yl]methylamino]-2-oxoethyl]-3-(trifluoromethoxy)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

483.15366 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 484.16094 211.1
[M+Na]+ 506.14288 214.2
[M-H]- 482.14638 213.9
[M+NH4]+ 501.18748 216.7
[M+K]+ 522.11682 207.6
[M+H-H2O]+ 466.15092 198.3
[M+HCOO]- 528.15186 219.9
[M+CH3COO]- 542.16751 238.3
[M+Na-2H]- 504.12833 209.7
[M]+ 483.15311 207.1
[M]- 483.15421 207.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.