1-naphthalen-1-yl-3-(thiolan-1-ium-1-yl)propan-2-one; tris(fluoranyl)methanesulfonate

Systemtic Name: 1-naphthalen-1-yl-3-(thiolan-1-ium-1-yl)propan-2-one; tris(fluoranyl)methanesulfonate Openeye Name: 1-(1-naphthyl)-3-tetrahydrothiophen-1-ium-1-yl-propan-2-one; trifluoromethanesulfonate CAS Name: 1-(1-naphthalenyl)-3-(1-thiolan-1-iumyl)-2-propanone; trifluoromethanesulfonate IUPAC Name: 1-naphthalen-1-yl-3-(thiolan-1-ium-1-yl)propan-2-one; trifluoromethanesulfonate Traditional Name: 1-(1-naphthyl)-3-tetrahydrothiophen-1-ium-1-yl-acetone triflate Formula: C18H19F3O4S2 MolecularWeight: 420.46627

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[S+](C1)CC(=O)CC2=CC=CC3=CC=CC=C32.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1CC[S+](C1)CC(=O)CC2=CC=CC3=CC=CC=C32.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C17H19OS.CHF3O3S/c18-16(13-19-10-3-4-11-19)12-15-8-5-7-14-6-1-2-9-17(14)15;2-1(3,4)8(5,6)7/h1-2,5-9H,3-4,10-13H2;(H,5,6,7)/q+1;/p-1