methyl 3-(3-cyanophenyl)-5-(trifluoromethyl)-4H-1,2-oxazole-5-carboxylate

Systemtic Name: methyl 3-(3-cyanophenyl)-5-(trifluoromethyl)-4H-1,2-oxazole-5-carboxylate Openeye Name: methyl 3-(3-cyanophenyl)-5-(trifluoromethyl)-4H-isoxazole-5-carboxylate CAS Name: 3-(3-cyanophenyl)-5-(trifluoromethyl)-4H-isoxazole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-(3-cyanophenyl)-5-(trifluoromethyl)-4H-1,2-oxazole-5-carboxylate Traditional Name: 3-(3-cyanophenyl)-5-(trifluoromethyl)-2-isoxazoline-5-carboxylic acid methyl ester Formula: C13H9F3N2O3 MolecularWeight: 298.21737

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC(=NO1)C2=CC=CC(=C2)C#N)C(F)(F)F

Isomeric SMILES

COC(=O)C1(CC(=NO1)C2=CC=CC(=C2)C#N)C(F)(F)F

InChI

InChI=1S/C13H9F3N2O3/c1-20-11(19)12(13(14,15)16)6-10(18-21-12)9-4-2-3-8(5-9)7-17/h2-5H,6H2,1H3