CID 45054984

2-(((2-(2-(benzyloxy)benzylidene)hydrazino)(oxo)acetyl)amino)-n-phenylbenzamide

Structural Information

Molecular Formula
C29H24N4O4
SMILES
C1=CC=C(C=C1)COC2=CC=CC=C2/C=N/NC(=O)C(=O)NC3=CC=CC=C3C(=O)NC4=CC=CC=C4
InChI
InChI=1S/C29H24N4O4/c34-27(31-23-14-5-2-6-15-23)24-16-8-9-17-25(24)32-28(35)29(36)33-30-19-22-13-7-10-18-26(22)37-20-21-11-3-1-4-12-21/h1-19H,20H2,(H,31,34)(H,32,35)(H,33,36)/b30-19+
InChIKey
YUAKPZFDUORZNO-NDZAJKAJSA-N
Compound name
N-[2-(phenylcarbamoyl)phenyl]-N'-[(E)-(2-phenylmethoxyphenyl)methylideneamino]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

492.17975 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 493.18703 216.9
[M+Na]+ 515.16897 217.5
[M-H]- 491.17247 229.2
[M+NH4]+ 510.21357 221.2
[M+K]+ 531.14291 213.2
[M+H-H2O]+ 475.17701 203.6
[M+HCOO]- 537.17795 242.1
[M+CH3COO]- 551.19360 248.5
[M+Na-2H]- 513.15442 220.2
[M]+ 492.17920 215.8
[M]- 492.18030 215.8
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.