3-(3-cyano-4-fluoranyl-phenyl)-5-methyl-4H-1,2-oxazole-5-carboxylic acid

Systemtic Name: 3-(3-cyano-4-fluoranyl-phenyl)-5-methyl-4H-1,2-oxazole-5-carboxylic acid Openeye Name: 3-(3-cyano-4-fluoro-phenyl)-5-methyl-4H-isoxazole-5-carboxylic acid CAS Name: 3-(3-cyano-4-fluorophenyl)-5-methyl-4H-isoxazole-5-carboxylic acid IUPAC Name: 3-(3-cyano-4-fluorophenyl)-5-methyl-4H-1,2-oxazole-5-carboxylic acid Traditional Name: 3-(3-cyano-4-fluoro-phenyl)-5-methyl-2-isoxazoline-5-carboxylic acid Formula: C12H9FN2O3 MolecularWeight: 248.209863

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=NO1)C2=CC(=C(C=C2)F)C#N)C(=O)O

Isomeric SMILES

CC1(CC(=NO1)C2=CC(=C(C=C2)F)C#N)C(=O)O

InChI

InChI=1S/C12H9FN2O3/c1-12(11(16)17)5-10(15-18-12)7-2-3-9(13)8(4-7)6-14/h2-4H,5H2,1H3,(H,16,17)