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2-(4-chlorophenyl)-N-(5-methyl-3-isoxazolyl)-4-quinolinecarboxamide

View entire compound with spectra: 2 NMR

2-(4-chlorophenyl)-N-(5-methyl-3-isoxazolyl)-4-quinolinecarboxamide
SpectraBase Compound ID 2bUVPf6nHTK
InChI InChI=1S/C20H14ClN3O2/c1-12-10-19(24-26-12)23-20(25)16-11-18(13-6-8-14(21)9-7-13)22-17-5-3-2-4-15(16)17/h2-11H,1H3,(H,23,24,25)
InChIKey YLBIAMGGBPGJDY-UHFFFAOYSA-N
Mol Weight 363.8 g/mol
Molecular Formula C20H14ClN3O2
Exact Mass 363.077454 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3rFSwvyWETU
Name 2-(4-Chlorophenyl)-N-(5-methyl-3-isoxazolyl)-4-quinolinecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 363.077454401 u
Formula C20H14ClN3O2
InChI InChI=1S/C20H14ClN3O2/c1-12-10-19(24-26-12)23-20(25)16-11-18(13-6-8-14(21)9-7-13)22-17-5-3-2-4-15(16)17/h2-11H,1H3,(H,23,24,25)
InChIKey YLBIAMGGBPGJDY-UHFFFAOYSA-N
Molecular Weight 363.804 g/mol
SMILES N(C1=NOC(=C1)C)C(C=1C=C(C2=CC=C(Cl)C=C2)N=C2C1C=CC=C2)=O