ethyl 4-[3-(trifluoromethyl)phenyl]carbonyl-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 4-[3-(trifluoromethyl)phenyl]carbonyl-1,2-oxazole-3-carboxylate Openeye Name: ethyl 4-[3-(trifluoromethyl)benzoyl]isoxazole-3-carboxylate CAS Name: 4-[oxo-[3-(trifluoromethyl)phenyl]methyl]-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(trifluoromethyl)benzoyl]-1,2-oxazole-3-carboxylate Traditional Name: 4-[3-(trifluoromethyl)benzoyl]isoxazole-3-carboxylic acid ethyl ester Formula: C14H10F3NO4 MolecularWeight: 313.22871

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC=C1C(=O)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=NOC=C1C(=O)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C14H10F3NO4/c1-2-21-13(20)11-10(7-22-18-11)12(19)8-4-3-5-9(6-8)14(15,16)17/h3-7H,2H2,1H3