CID 54687742

N-(4-chlorophenyl)-4-hydroxy-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydroquinoline-3-carboxamide

Structural Information

Molecular Formula
C19H15ClN2O3
SMILES
C=CCN1C2=CC=CC=C2C(=C(C1=O)C(=O)NC3=CC=C(C=C3)Cl)O
InChI
InChI=1S/C19H15ClN2O3/c1-2-11-22-15-6-4-3-5-14(15)17(23)16(19(22)25)18(24)21-13-9-7-12(20)8-10-13/h2-10,23H,1,11H2,(H,21,24)
InChIKey
ZKVBYIUCONWADJ-UHFFFAOYSA-N
Compound name
N-(4-chlorophenyl)-4-hydroxy-2-oxo-1-prop-2-enylquinoline-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

354.07712 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.08440 180.2
[M+Na]+ 377.06634 190.3
[M-H]- 353.06984 185.8
[M+NH4]+ 372.11094 193.0
[M+K]+ 393.04028 182.8
[M+H-H2O]+ 337.07438 172.2
[M+HCOO]- 399.07532 196.3
[M+CH3COO]- 413.09097 213.8
[M+Na-2H]- 375.05179 183.7
[M]+ 354.07657 183.6
[M]- 354.07767 183.6
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.