Metabolite 4-hydroxy-N-methyl-2-oxo-N-phenyl-1,2-dihydroquinoline-3-carboxamide

Name

4-hydroxy-N-methyl-2-oxo-N-phenyl-1,2-dihydroquinoline-3-carboxamide

Description

Not Available

Structure

Similar Structures

Synonyms

Not Available

UNII

Not Available

CAS number

Not Available

Weight

Average: 294.31
Monoisotopic: 294.100442319

Chemical Formula

C₁₇H₁₄N₂O₃

InChI Key

ZZCUZAQEHJPLGL-UHFFFAOYSA-N

InChI

InChI=1S/C17H14N2O3/c1-19(11-7-3-2-4-8-11)17(22)14-15(20)12-9-5-6-10-13(12)18-16(14)21/h2-10H,1H3,(H2,18,20,21)

IUPAC Name

4-hydroxy-N-methyl-2-oxo-N-phenyl-1,2-dihydroquinoline-3-carboxamide

SMILES

[H]OC1=C(C(=O)N(C2=C([H])C([H])=C([H])C([H])=C2[H])C([H])([H])[H])C(=O)NC2=C1C([H])=C([H])C([H])=C2[H]

Reactions

Spectra

Spectrum	Spectrum Type	Splash Key
Predicted MS/MS Spectrum - 10V, Positive (Annotated)	Predicted LC-MS/MS	splash10-000i-0900000000-e1d355f786690e5ad23d
Predicted MS/MS Spectrum - 10V, Negative (Annotated)	Predicted LC-MS/MS	splash10-000l-0980000000-196e88a9bf2d14efe88f
Predicted MS/MS Spectrum - 20V, Positive (Annotated)	Predicted LC-MS/MS	splash10-000i-0900000000-47b80ee6d1a4c488b37c
Predicted MS/MS Spectrum - 20V, Negative (Annotated)	Predicted LC-MS/MS	splash10-000i-0900000000-ede7706e738d47d54a48
Predicted MS/MS Spectrum - 40V, Positive (Annotated)	Predicted LC-MS/MS	splash10-00di-2900000000-30ca62ee92ba681266ff
Predicted MS/MS Spectrum - 40V, Negative (Annotated)	Predicted LC-MS/MS	splash10-014i-6920000000-7a0fb93dbc8f2aeef3eb

Chromatographic Properties

Adduct	CCS Value (Å²)	Source type	Source
[M-H]-	167.38298	predicted	DeepCCS 1.0 (2019)
[M+H]+	169.20789	predicted	DeepCCS 1.0 (2019)
[M+Na]+	174.93364	predicted	DeepCCS 1.0 (2019)

External Links

Predicted Properties