1-(3-phenylprop-2-ynylidene)piperidin-1-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 1-(3-phenylprop-2-ynylidene)piperidin-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: 1-(3-phenylprop-2-ynylidene)piperidin-1-ium; trifluoromethanesulfonate CAS Name: 1-(3-phenylprop-2-ynylidene)piperidin-1-ium; trifluoromethanesulfonate IUPAC Name: 1-(3-phenylprop-2-ynylidene)piperidin-1-ium; trifluoromethanesulfonate Traditional Name: 1-(3-phenylprop-2-ynylidene)piperidin-1-ium triflate Formula: C15H16F3NO3S MolecularWeight: 347.35265

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](=CC#CC2=CC=CC=C2)CC1.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1CC[N+](=CC#CC2=CC=CC=C2)CC1.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C14H16N.CHF3O3S/c1-3-8-14(9-4-1)10-7-13-15-11-5-2-6-12-15;2-1(3,4)8(5,6)7/h1,3-4,8-9,13H,2,5-6,11-12H2;(H,5,6,7)/q+1;/p-1