CID 176514006

N-[(e)-(4-chlorophenyl)methyleneamino]-4-hydroxy-2-oxo-1h-quinoline-3-carboxamide

Structural Information

Molecular Formula
C17H12ClN3O3
SMILES
C1=CC=C2C(=C1)C(=C(C(=O)N2)C(=O)N/N=C/C3=CC=C(C=C3)Cl)O
InChI
InChI=1S/C17H12ClN3O3/c18-11-7-5-10(6-8-11)9-19-21-17(24)14-15(22)12-3-1-2-4-13(12)20-16(14)23/h1-9H,(H,21,24)(H2,20,22,23)/b19-9+
InChIKey
JLEKUROYYVXWRH-DJKKODMXSA-N
Compound name
N-[(E)-(4-chlorophenyl)methylideneamino]-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.05673 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.06401 174.7
[M+Na]+ 364.04595 184.0
[M-H]- 340.04945 180.2
[M+NH4]+ 359.09055 187.5
[M+K]+ 380.01989 177.0
[M+H-H2O]+ 324.05399 166.7
[M+HCOO]- 386.05493 192.7
[M+CH3COO]- 400.07058 211.3
[M+Na-2H]- 362.03140 180.6
[M]+ 341.05618 176.4
[M]- 341.05728 176.4
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

No patent data available for this compound.