thallium(1+); 3-(trifluoromethyl)benzoate

Systemtic Name: thallium(1+); 3-(trifluoromethyl)benzoate Openeye Name: thallium(1+); 3-(trifluoromethyl)benzoate CAS Name: thallium(1+); 3-(trifluoromethyl)benzoate IUPAC Name: thallium(1+); 3-(trifluoromethyl)benzoate Traditional Name: thallium(1+); 3-(trifluoromethyl)benzoate Formula: C8H4F3O2Tl MolecularWeight: 393.49467

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C(=O)[O-].[Tl+]

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C(=O)[O-].[Tl+]

InChI

InChI=1S/C8H5F3O2.Tl/c9-8(10,11)6-3-1-2-5(4-6)7(12)13;/h1-4H,(H,12,13);/q;+1/p-1