ethyl 1-(hydroxymethyl)-3-(trifluoromethyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(hydroxymethyl)-3-(trifluoromethyl)pyrazole-4-carboxylate Openeye Name: ethyl 1-(hydroxymethyl)-3-(trifluoromethyl)pyrazole-4-carboxylate CAS Name: 1-(hydroxymethyl)-3-(trifluoromethyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(hydroxymethyl)-3-(trifluoromethyl)pyrazole-4-carboxylate Traditional Name: 1-methylol-3-(trifluoromethyl)pyrazole-4-carboxylic acid ethyl ester Formula: C8H9F3N2O3 MolecularWeight: 238.16387

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(N=C1C(F)(F)F)CO

Isomeric SMILES

CCOC(=O)C1=CN(N=C1C(F)(F)F)CO

InChI

InChI=1S/C8H9F3N2O3/c1-2-16-7(15)5-3-13(4-14)12-6(5)8(9,10)11/h3,14H,2,4H2,1H3