4-chloranyl-1-[2,2,2-tris(fluoranyl)ethoxymethyl]pyrazole-3-carboxylate

Systemtic Name: 4-chloranyl-1-[2,2,2-tris(fluoranyl)ethoxymethyl]pyrazole-3-carboxylate Openeye Name: 4-chloro-1-(2,2,2-trifluoroethoxymethyl)pyrazole-3-carboxylate CAS Name: 4-chloro-1-(2,2,2-trifluoroethoxymethyl)-3-pyrazolecarboxylate IUPAC Name: 4-chloro-1-(2,2,2-trifluoroethoxymethyl)pyrazole-3-carboxylate Traditional Name: 4-chloro-1-(2,2,2-trifluoroethoxymethyl)pyrazole-3-carboxylate Formula: C7H5ClF3N2O3- MolecularWeight: 257.57441

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=NN1COCC(F)(F)F)C(=O)[O-])Cl

Isomeric SMILES

C1=C(C(=NN1COCC(F)(F)F)C(=O)[O-])Cl

InChI

InChI=1S/C7H6ClF3N2O3/c8-4-1-13(12-5(4)6(14)15)3-16-2-7(9,10)11/h1H,2-3H2,(H,14,15)/p-1