CID 51060206

2-((1-bromo-2-naphthyl)oxy)-n'-(4-((4-chlorobenzyl)oxy)-3-ethoxybenzylidene)acetohydrazide

Structural Information

Molecular Formula
C28H24BrClN2O4
SMILES
CCOC1=C(C=CC(=C1)/C=N/NC(=O)COC2=C(C3=CC=CC=C3C=C2)Br)OCC4=CC=C(C=C4)Cl
InChI
InChI=1S/C28H24BrClN2O4/c1-2-34-26-15-20(9-13-24(26)35-17-19-7-11-22(30)12-8-19)16-31-32-27(33)18-36-25-14-10-21-5-3-4-6-23(21)28(25)29/h3-16H,2,17-18H2,1H3,(H,32,33)/b31-16+
InChIKey
LVLYOJBWOLDIGX-WCMJOSRZSA-N
Compound name
2-(1-bromonaphthalen-2-yl)oxy-N-[(E)-[4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

566.0608 Da
Monoisotopic Mass

7.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 567.06808 227.2
[M+Na]+ 589.05002 235.4
[M-H]- 565.05352 239.7
[M+NH4]+ 584.09462 236.6
[M+K]+ 605.02396 222.3
[M+H-H2O]+ 549.05806 221.9
[M+HCOO]- 611.05900 243.6
[M+CH3COO]- 625.07465 250.5
[M+Na-2H]- 587.03547 229.9
[M]+ 566.06025 252.6
[M]- 566.06135 252.6
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.