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

Systemtic Name: 3-(2-propan-2-yloxynaphthalen-1-yl)thiolan-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: 3-(2-isopropoxy-1-naphthyl)tetrahydrothiophen-1-ium; trifluoromethanesulfonate CAS Name: 3-(2-propan-2-yloxy-1-naphthalenyl)thiolan-1-ium; trifluoromethanesulfonate IUPAC Name: 3-(2-propan-2-yloxynaphthalen-1-yl)thiolan-1-ium; trifluoromethanesulfonate Traditional Name: 3-(2-isopropoxy-1-naphthyl)tetrahydrothiophen-1-ium triflate Formula: C18H21F3O4S2 MolecularWeight: 422.48215

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C2=CC=CC=C2C=C1)C3CC[SH+]C3.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CC(C)OC1=C(C2=CC=CC=C2C=C1)C3CC[SH+]C3.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C17H20OS.CHF3O3S/c1-12(2)18-16-8-7-13-5-3-4-6-15(13)17(16)14-9-10-19-11-14;2-1(3,4)8(5,6)7/h3-8,12,14H,9-11H2,1-2H3;(H,5,6,7)