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4-chloro-N-[(-5-methyl-4-isoxazolyl)carbonyl]anthranilic acid, methyl ester

View entire compound with spectra: 2 NMR

4-chloro-N-[(-5-methyl-4-isoxazolyl)carbonyl]anthranilic acid, methyl ester
SpectraBase Compound ID CKhpjDFiao
InChI InChI=1S/C19H15ClN2O4/c1-11-16(12-6-4-3-5-7-12)22-26-17(11)18(23)21-15-10-13(20)8-9-14(15)19(24)25-2/h3-10H,1-2H3,(H,21,23)
InChIKey XAAJSYSFLLZKEN-UHFFFAOYSA-N
Mol Weight 370.79 g/mol
Molecular Formula C19H15ClN2O4
Exact Mass 370.072035 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DPOjcBcKUaP
Name 4-Chloro-N-[(-5-methyl-4-isoxazolyl)carbonyl]anthranilic acid, methyl ester
Comments Computed using HOSE algorithm
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Exact Mass 370.072034667 u
Formula C19H15ClN2O4
InChI InChI=1S/C19H15ClN2O4/c1-11-16(12-6-4-3-5-7-12)22-26-17(11)18(23)21-15-10-13(20)8-9-14(15)19(24)25-2/h3-10H,1-2H3,(H,21,23)
InChIKey XAAJSYSFLLZKEN-UHFFFAOYSA-N
Molecular Weight 370.792 g/mol
SMILES N(C1=CC(=CC=C1C(=O)OC)Cl)C(C1=C(C(=NO1)C=1C=CC=CC1)C)=O