CID 54676653

303093-38-1

Structural Information

Molecular Formula
C20H20N2O4
SMILES
CCCN1C2=CC=CC=C2C(=C(C1=O)C(=O)NC3=CC(=CC=C3)OC)O
InChI
InChI=1S/C20H20N2O4/c1-3-11-22-16-10-5-4-9-15(16)18(23)17(20(22)25)19(24)21-13-7-6-8-14(12-13)26-2/h4-10,12,23H,3,11H2,1-2H3,(H,21,24)
InChIKey
JMYJYHMURAWXTR-UHFFFAOYSA-N
Compound name
4-hydroxy-N-(3-methoxyphenyl)-2-oxo-1-propylquinoline-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

352.1423 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.14958 183.3
[M+Na]+ 375.13152 197.6
[M+NH4]+ 370.17612 189.6
[M+K]+ 391.10546 190.5
[M-H]- 351.13502 187.0
[M+Na-2H]- 373.11697 190.0
[M]+ 352.14175 186.3
[M]- 352.14285 186.3
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.