sodium 2-sulfanyl-4-(trifluoromethyl)phenolate

Systemtic Name: sodium 2-sulfanyl-4-(trifluoromethyl)phenolate Openeye Name: sodium 2-sulfanyl-4-(trifluoromethyl)phenolate CAS Name: sodium 2-mercapto-4-(trifluoromethyl)phenolate IUPAC Name: sodium 2-sulfanyl-4-(trifluoromethyl)phenolate Traditional Name: sodium 2-mercapto-4-(trifluoromethyl)phenolate Formula: C7H4F3NaOS MolecularWeight: 216.15604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)S)[O-].[Na+]

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)S)[O-].[Na+]

InChI

InChI=1S/C7H5F3OS.Na/c8-7(9,10)4-1-2-5(11)6(12)3-4;/h1-3,11-12H;/q;+1/p-1