3-ethyl-5,6-dimethoxy-2-methyl-1,3-benzotellurazol-3-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 3-ethyl-5,6-dimethoxy-2-methyl-1,3-benzotellurazol-3-ium; tris(fluoranyl)methanesulfonate Openeye Name: 3-ethyl-5,6-dimethoxy-2-methyl-1,3-benzotellurazol-3-ium; trifluoromethanesulfonate CAS Name: 3-ethyl-5,6-dimethoxy-2-methyl-1,3-benzotellurazol-3-ium; trifluoromethanesulfonate IUPAC Name: 3-ethyl-5,6-dimethoxy-2-methyl-1,3-benzotellurazol-3-ium; trifluoromethanesulfonate Traditional Name: 3-ethyl-5,6-dimethoxy-2-methyl-1,3-benzotellurazol-3-ium triflate Formula: C13H16F3NO5STe MolecularWeight: 482.93005

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C([Te]C2=CC(=C(C=C21)OC)OC)C.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CC[N+]1=C([Te]C2=CC(=C(C=C21)OC)OC)C.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C12H16NO2Te.CHF3O3S/c1-5-13-8(2)16-12-7-11(15-4)10(14-3)6-9(12)13;2-1(3,4)8(5,6)7/h6-7H,5H2,1-4H3;(H,5,6,7)/q+1;/p-1