4-bromanyl-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxylate

Systemtic Name: 4-bromanyl-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxylate Openeye Name: 4-bromo-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxylate CAS Name: 4-bromo-1-methyl-5-(trifluoromethyl)-3-pyrazolecarboxylate IUPAC Name: 4-bromo-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxylate Traditional Name: 4-bromo-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxylate Formula: C6H3BrF3N2O2- MolecularWeight: 271.99943

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(=O)[O-])Br)C(F)(F)F

Isomeric SMILES

CN1C(=C(C(=N1)C(=O)[O-])Br)C(F)(F)F

InChI

InChI=1S/C6H4BrF3N2O2/c1-12-4(6(8,9)10)2(7)3(11-12)5(13)14/h1H3,(H,13,14)/p-1