CID 16076160

6-chloro-2-(4-chlorophenyl)-n-[(e)-(4-methoxyphenyl)methyleneamino]quinoline-4-carboxamide

Structural Information

Molecular Formula
C24H17Cl2N3O2
SMILES
COC1=CC=C(C=C1)/C=N/NC(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CC=C(C=C4)Cl
InChI
InChI=1S/C24H17Cl2N3O2/c1-31-19-9-2-15(3-10-19)14-27-29-24(30)21-13-23(16-4-6-17(25)7-5-16)28-22-11-8-18(26)12-20(21)22/h2-14H,1H3,(H,29,30)/b27-14+
InChIKey
RBRIJBHEEPOGEX-MZJWZYIUSA-N
Compound name
6-chloro-2-(4-chlorophenyl)-N-[(E)-(4-methoxyphenyl)methylideneamino]quinoline-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

449.0698 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 450.07708 206.1
[M+Na]+ 472.05902 215.3
[M-H]- 448.06252 215.6
[M+NH4]+ 467.10362 215.9
[M+K]+ 488.03296 207.2
[M+H-H2O]+ 432.06706 195.4
[M+HCOO]- 494.06800 220.0
[M+CH3COO]- 508.08365 215.2
[M+Na-2H]- 470.04447 209.6
[M]+ 449.06925 212.2
[M]- 449.07035 212.2
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.