CID 54676680

75483-06-6

Structural Information

Molecular Formula
C18H16N2O4
SMILES
CN1C2=CC=CC=C2C(=C(C1=O)C(=O)NC3=CC=C(C=C3)OC)O
InChI
InChI=1S/C18H16N2O4/c1-20-14-6-4-3-5-13(14)16(21)15(18(20)23)17(22)19-11-7-9-12(24-2)10-8-11/h3-10,21H,1-2H3,(H,19,22)
InChIKey
CENDRMDHKCMYQR-UHFFFAOYSA-N
Compound name
4-hydroxy-N-(4-methoxyphenyl)-1-methyl-2-oxoquinoline-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

324.111 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.11828 174.3
[M+Na]+ 347.10022 189.0
[M+NH4]+ 342.14482 180.9
[M+K]+ 363.07416 182.4
[M-H]- 323.10372 178.0
[M+Na-2H]- 345.08567 181.5
[M]+ 324.11045 177.4
[M]- 324.11155 177.4
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

patents stripe