ethyl 1-ethyl-5-(trifluoromethyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 1-ethyl-5-(trifluoromethyl)pyrazole-4-carboxylate Openeye Name: ethyl 1-ethyl-5-(trifluoromethyl)pyrazole-4-carboxylate CAS Name: 1-ethyl-5-(trifluoromethyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-5-(trifluoromethyl)pyrazole-4-carboxylate Traditional Name: 1-ethyl-5-(trifluoromethyl)pyrazole-4-carboxylic acid ethyl ester Formula: C9H11F3N2O2 MolecularWeight: 236.19105

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)C(=O)OCC)C(F)(F)F

Isomeric SMILES

CCN1C(=C(C=N1)C(=O)OCC)C(F)(F)F

InChI

InChI=1S/C9H11F3N2O2/c1-3-14-7(9(10,11)12)6(5-13-14)8(15)16-4-2/h5H,3-4H2,1-2H3