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

Systemtic Name: methyl 3-(4-methylphenyl)-5-(trifluoromethyl)-1,2-oxazole-4-carboxylate Openeye Name: methyl 3-(p-tolyl)-5-(trifluoromethyl)isoxazole-4-carboxylate CAS Name: 3-(4-methylphenyl)-5-(trifluoromethyl)-4-isoxazolecarboxylic acid methyl ester IUPAC Name: methyl 3-(4-methylphenyl)-5-(trifluoromethyl)-1,2-oxazole-4-carboxylate Traditional Name: 3-(p-tolyl)-5-(trifluoromethyl)isoxazole-4-carboxylic acid methyl ester Formula: C13H10F3NO3 MolecularWeight: 285.21861

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=C2C(=O)OC)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=C2C(=O)OC)C(F)(F)F

InChI

InChI=1S/C13H10F3NO3/c1-7-3-5-8(6-4-7)10-9(12(18)19-2)11(20-17-10)13(14,15)16/h3-6H,1-2H3