3-(2-cyano-6-fluoranyl-phenyl)-5-methyl-1,2-oxazole-4-carboxylic acid

Systemtic Name: 3-(2-cyano-6-fluoranyl-phenyl)-5-methyl-1,2-oxazole-4-carboxylic acid Openeye Name: 3-(2-cyano-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxylic acid CAS Name: 3-(2-cyano-6-fluorophenyl)-5-methyl-4-isoxazolecarboxylic acid IUPAC Name: 3-(2-cyano-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxylic acid Traditional Name: 3-(2-cyano-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxylic acid Formula: C12H7FN2O3 MolecularWeight: 246.193983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=C(C=CC=C2F)C#N)C(=O)O

Isomeric SMILES

CC1=C(C(=NO1)C2=C(C=CC=C2F)C#N)C(=O)O

InChI

InChI=1S/C12H7FN2O3/c1-6-9(12(16)17)11(15-18-6)10-7(5-14)3-2-4-8(10)13/h2-4H,1H3,(H,16,17)