5-methoxy-2-methyl-3-prop-2-enyl-1,3-benzotellurazol-3-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 5-methoxy-2-methyl-3-prop-2-enyl-1,3-benzotellurazol-3-ium; tris(fluoranyl)methanesulfonate Openeye Name: 3-allyl-5-methoxy-2-methyl-1,3-benzotellurazol-3-ium; trifluoromethanesulfonate CAS Name: 5-methoxy-2-methyl-3-prop-2-enyl-1,3-benzotellurazol-3-ium; trifluoromethanesulfonate IUPAC Name: 5-methoxy-2-methyl-3-prop-2-enyl-1,3-benzotellurazol-3-ium; trifluoromethanesulfonate Traditional Name: 3-allyl-5-methoxy-2-methyl-1,3-benzotellurazol-3-ium triflate Formula: C13H14F3NO4STe MolecularWeight: 464.91477

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C([Te]1)C=CC(=C2)OC)CC=C.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CC1=[N+](C2=C([Te]1)C=CC(=C2)OC)CC=C.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C12H14NOTe.CHF3O3S/c1-4-7-13-9(2)15-12-6-5-10(14-3)8-11(12)13;2-1(3,4)8(5,6)7/h4-6,8H,1,7H2,2-3H3;(H,5,6,7)/q+1;/p-1