1-dodecyl-1-methyl-piperidin-1-ium-4-one; tris(fluoranyl)methanesulfonate

Systemtic Name: 1-dodecyl-1-methyl-piperidin-1-ium-4-one; tris(fluoranyl)methanesulfonate Openeye Name: 1-dodecyl-1-methyl-piperidin-1-ium-4-one; trifluoromethanesulfonate CAS Name: 1-dodecyl-1-methyl-4-piperidin-1-iumone; trifluoromethanesulfonate IUPAC Name: 1-dodecyl-1-methylpiperidin-1-ium-4-one; trifluoromethanesulfonate Traditional Name: 1-lauryl-1-methyl-piperidin-1-ium-4-one triflate Formula: C19H36F3NO4S MolecularWeight: 431.55365

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+]1(CCC(=O)CC1)C.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC[N+]1(CCC(=O)CC1)C.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C18H36NO.CHF3O3S/c1-3-4-5-6-7-8-9-10-11-12-15-19(2)16-13-18(20)14-17-19;2-1(3,4)8(5,6)7/h3-17H2,1-2H3;(H,5,6,7)/q+1;/p-1