1-(1,4-dithian-1-ium-1-yl)hexan-2-one; tris(fluoranyl)methanesulfonate

Systemtic Name: 1-(1,4-dithian-1-ium-1-yl)hexan-2-one; tris(fluoranyl)methanesulfonate Openeye Name: 1-(1,4-dithian-1-ium-1-yl)hexan-2-one; trifluoromethanesulfonate CAS Name: 1-(1,4-dithian-1-ium-1-yl)-2-hexanone; trifluoromethanesulfonate IUPAC Name: 1-(1,4-dithian-1-ium-1-yl)hexan-2-one; trifluoromethanesulfonate Traditional Name: 1-(1,4-dithian-1-ium-1-yl)hexan-2-one triflate Formula: C11H19F3O4S3 MolecularWeight: 368.45637

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C[S+]1CCSCC1.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCCCC(=O)C[S+]1CCSCC1.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C10H19OS2.CHF3O3S/c1-2-3-4-10(11)9-13-7-5-12-6-8-13;2-1(3,4)8(5,6)7/h2-9H2,1H3;(H,5,6,7)/q+1;/p-1