2-[3-(4-methoxyphenyl)-5-(phenethylcarbamoyl)-4H-1,2-oxazol-5-yl]ethanoic acid

Systemtic Name: 2-[3-(4-methoxyphenyl)-5-(phenethylcarbamoyl)-4H-1,2-oxazol-5-yl]ethanoic acid Openeye Name: 2-[3-(4-methoxyphenyl)-5-(phenethylcarbamoyl)-4H-isoxazol-5-yl]acetic acid CAS Name: 2-[3-(4-methoxyphenyl)-5-[oxo-(phenethylamino)methyl]-4H-isoxazol-5-yl]acetic acid IUPAC Name: 2-[3-(4-methoxyphenyl)-5-(phenethylcarbamoyl)-4H-1,2-oxazol-5-yl]acetic acid Traditional Name: 2-[3-(4-methoxyphenyl)-5-(phenethylcarbamoyl)-2-isoxazolin-5-yl]acetic acid Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(C2)(CC(=O)O)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(C2)(CC(=O)O)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O5/c1-27-17-9-7-16(8-10-17)18-13-21(28-23-18,14-19(24)25)20(26)22-12-11-15-5-3-2-4-6-15/h2-10H,11-14H2,1H3,(H,22,26)(H,24,25)