2-[3-(3,4-dimethoxyphenyl)-5-(pyridin-2-ylcarbamoyl)-4H-1,2-oxazol-5-yl]ethanoic acid

Systemtic Name: 2-[3-(3,4-dimethoxyphenyl)-5-(pyridin-2-ylcarbamoyl)-4H-1,2-oxazol-5-yl]ethanoic acid Openeye Name: 2-[3-(3,4-dimethoxyphenyl)-5-(2-pyridylcarbamoyl)-4H-isoxazol-5-yl]acetic acid CAS Name: 2-[3-(3,4-dimethoxyphenyl)-5-[oxo-(2-pyridinylamino)methyl]-4H-isoxazol-5-yl]acetic acid IUPAC Name: 2-[3-(3,4-dimethoxyphenyl)-5-(pyridin-2-ylcarbamoyl)-4H-1,2-oxazol-5-yl]acetic acid Traditional Name: 2-[3-(3,4-dimethoxyphenyl)-5-(2-pyridylcarbamoyl)-2-isoxazolin-5-yl]acetic acid Formula: C19H19N3O6 MolecularWeight: 385.37066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(C2)(CC(=O)O)C(=O)NC3=CC=CC=N3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(C2)(CC(=O)O)C(=O)NC3=CC=CC=N3)OC

InChI

InChI=1S/C19H19N3O6/c1-26-14-7-6-12(9-15(14)27-2)13-10-19(28-22-13,11-17(23)24)18(25)21-16-5-3-4-8-20-16/h3-9H,10-11H2,1-2H3,(H,23,24)(H,20,21,25)