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

Systemtic Name: 2-[3-(2-prop-2-enoxyphenyl)-5-(pyridin-2-ylcarbamoyl)-4H-1,2-oxazol-5-yl]ethanoic acid Openeye Name: 2-[3-(2-allyloxyphenyl)-5-(2-pyridylcarbamoyl)-4H-isoxazol-5-yl]acetic acid CAS Name: 2-[5-[oxo-(2-pyridinylamino)methyl]-3-(2-prop-2-enoxyphenyl)-4H-isoxazol-5-yl]acetic acid IUPAC Name: 2-[3-(2-prop-2-enoxyphenyl)-5-(pyridin-2-ylcarbamoyl)-4H-1,2-oxazol-5-yl]acetic acid Traditional Name: 2-[3-(2-allyloxyphenyl)-5-(2-pyridylcarbamoyl)-2-isoxazolin-5-yl]acetic acid Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=CC=C1C2=NOC(C2)(CC(=O)O)C(=O)NC3=CC=CC=N3

Isomeric SMILES

C=CCOC1=CC=CC=C1C2=NOC(C2)(CC(=O)O)C(=O)NC3=CC=CC=N3

InChI

InChI=1S/C20H19N3O5/c1-2-11-27-16-8-4-3-7-14(16)15-12-20(28-23-15,13-18(24)25)19(26)22-17-9-5-6-10-21-17/h2-10H,1,11-13H2,(H,24,25)(H,21,22,26)