sodium 4-ethyl-5-(trifluoromethyl)-1,2,4-triazole-3-sulfonate

Systemtic Name: sodium 4-ethyl-5-(trifluoromethyl)-1,2,4-triazole-3-sulfonate Openeye Name: sodium 4-ethyl-5-(trifluoromethyl)-1,2,4-triazole-3-sulfonate CAS Name: sodium 4-ethyl-5-(trifluoromethyl)-1,2,4-triazole-3-sulfonate IUPAC Name: sodium 4-ethyl-5-(trifluoromethyl)-1,2,4-triazole-3-sulfonate Traditional Name: sodium 4-ethyl-5-(trifluoromethyl)-1,2,4-triazole-3-sulfonate Formula: C5H5F3N3NaO3S MolecularWeight: 267.16148

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1S(=O)(=O)[O-])C(F)(F)F.[Na+]

Isomeric SMILES

CCN1C(=NN=C1S(=O)(=O)[O-])C(F)(F)F.[Na+]

InChI

InChI=1S/C5H6F3N3O3S.Na/c1-2-11-3(5(6,7)8)9-10-4(11)15(12,13)14;/h2H2,1H3,(H,12,13,14);/q;+1/p-1