(phenylmethyl) 4-(4-fluorophenyl)-5-oxidanylidene-3-pyridin-4-yl-1,2-oxazole-2-carboxylate

Systemtic Name: (phenylmethyl) 4-(4-fluorophenyl)-5-oxidanylidene-3-pyridin-4-yl-1,2-oxazole-2-carboxylate Openeye Name: benzyl 4-(4-fluorophenyl)-5-oxo-3-(4-pyridyl)isoxazole-2-carboxylate CAS Name: 4-(4-fluorophenyl)-5-oxo-3-pyridin-4-yl-2-isoxazolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(4-fluorophenyl)-5-oxo-3-pyridin-4-yl-1,2-oxazole-2-carboxylate Traditional Name: 4-(4-fluorophenyl)-5-keto-3-(4-pyridyl)-3-isoxazoline-2-carboxylic acid benzyl ester Formula: C22H15FN2O4 MolecularWeight: 390.363903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N2C(=C(C(=O)O2)C3=CC=C(C=C3)F)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N2C(=C(C(=O)O2)C3=CC=C(C=C3)F)C4=CC=NC=C4

InChI

InChI=1S/C22H15FN2O4/c23-18-8-6-16(7-9-18)19-20(17-10-12-24-13-11-17)25(29-21(19)26)22(27)28-14-15-4-2-1-3-5-15/h1-13H,14H2