1,1-dimethylpiperidin-1-ium-3-one; tris(fluoranyl)methanesulfonate

Systemtic Name: 1,1-dimethylpiperidin-1-ium-3-one; tris(fluoranyl)methanesulfonate Openeye Name: 1,1-dimethylpiperidin-1-ium-3-one; trifluoromethanesulfonate CAS Name: 1,1-dimethyl-3-piperidin-1-iumone; trifluoromethanesulfonate IUPAC Name: 1,1-dimethylpiperidin-1-ium-3-one; trifluoromethanesulfonate Traditional Name: 1,1-dimethylpiperidin-1-ium-3-one triflate Formula: C8H14F3NO4S MolecularWeight: 277.26127

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC(=O)C1)C.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C[N+]1(CCCC(=O)C1)C.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C7H14NO.CHF3O3S/c1-8(2)5-3-4-7(9)6-8;2-1(3,4)8(5,6)7/h3-6H2,1-2H3;(H,5,6,7)/q+1;/p-1