propyl [5-(thiolan-1-ium-1-yl)naphthalen-2-yl] carbonate; tris(fluoranyl)methanesulfonate

Systemtic Name: propyl [5-(thiolan-1-ium-1-yl)naphthalen-2-yl] carbonate; tris(fluoranyl)methanesulfonate Openeye Name: propyl (5-tetrahydrothiophen-1-ium-1-yl-2-naphthyl) carbonate; trifluoromethanesulfonate CAS Name: carbonic acid propyl [5-(1-thiolan-1-iumyl)-2-naphthalenyl] ester; trifluoromethanesulfonate IUPAC Name: propyl [5-(thiolan-1-ium-1-yl)naphthalen-2-yl] carbonate; trifluoromethanesulfonate Traditional Name: carbonic acid propyl (5-tetrahydrothiophen-1-ium-1-yl-2-naphthyl) ester triflate Formula: C19H21F3O6S2 MolecularWeight: 466.49165

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)OC1=CC2=C(C=C1)C(=CC=C2)[S+]3CCCC3.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCCOC(=O)OC1=CC2=C(C=C1)C(=CC=C2)[S+]3CCCC3.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C18H21O3S.CHF3O3S/c1-2-10-20-18(19)21-15-8-9-16-14(13-15)6-5-7-17(16)22-11-3-4-12-22;2-1(3,4)8(5,6)7/h5-9,13H,2-4,10-12H2,1H3;(H,5,6,7)/q+1;/p-1