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3-(2-chlorophenyl)-N-(3-methoxyphenyl)-5-methyl-4-isoxazolecarboxamide

View entire compound with spectra: 2 NMR

3-(2-chlorophenyl)-N-(3-methoxyphenyl)-5-methyl-4-isoxazolecarboxamide
SpectraBase Compound ID CBjDXazPCDs
InChI InChI=1S/C18H15ClN2O3/c1-11-16(17(21-24-11)14-8-3-4-9-15(14)19)18(22)20-12-6-5-7-13(10-12)23-2/h3-10H,1-2H3,(H,20,22)
InChIKey QEAXKUZLELFGNF-UHFFFAOYSA-N
Mol Weight 342.78 g/mol
Molecular Formula C18H15ClN2O3
Exact Mass 342.07712 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AKjkX7WpxEF
Name 3-(2-Chlorophenyl)-N-(3-methoxyphenyl)-5-methyl-4-isoxazolecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 342.077120048 u
Formula C18H15ClN2O3
InChI InChI=1S/C18H15ClN2O3/c1-11-16(17(21-24-11)14-8-3-4-9-15(14)19)18(22)20-12-6-5-7-13(10-12)23-2/h3-10H,1-2H3,(H,20,22)
InChIKey QEAXKUZLELFGNF-UHFFFAOYSA-N
Molecular Weight 342.782 g/mol
SMILES N(C(C=1C(=NOC1C)C=1C(Cl)=CC=CC1)=O)C1=CC(OC)=CC=C1