4-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-5-methyl-1,2-oxazole-3-carboxylic acid

Systemtic Name: 4-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-5-methyl-1,2-oxazole-3-carboxylic acid Openeye Name: 4-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-5-methyl-isoxazole-3-carboxylic acid CAS Name: 4-[[5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]methyl]-5-methyl-3-isoxazolecarboxylic acid IUPAC Name: 4-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-5-methyl-1,2-oxazole-3-carboxylic acid Traditional Name: 4-[[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]-5-methyl-isoxazole-3-carboxylic acid Formula: C13H12F3N3O3 MolecularWeight: 315.24789

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C(=O)O)CN2C(=CC(=N2)C(F)(F)F)C3CC3

Isomeric SMILES

CC1=C(C(=NO1)C(=O)O)CN2C(=CC(=N2)C(F)(F)F)C3CC3

InChI

InChI=1S/C13H12F3N3O3/c1-6-8(11(12(20)21)18-22-6)5-19-9(7-2-3-7)4-10(17-19)13(14,15)16/h4,7H,2-3,5H2,1H3,(H,20,21)