1-(6-propoxynaphthalen-1-yl)thiolan-1-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 1-(6-propoxynaphthalen-1-yl)thiolan-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: 1-(6-propoxy-1-naphthyl)tetrahydrothiophen-1-ium; trifluoromethanesulfonate CAS Name: 1-(6-propoxy-1-naphthalenyl)thiolan-1-ium; trifluoromethanesulfonate IUPAC Name: 1-(6-propoxynaphthalen-1-yl)thiolan-1-ium; trifluoromethanesulfonate Traditional Name: 1-(6-propoxy-1-naphthyl)tetrahydrothiophen-1-ium triflate Formula: C18H21F3O4S2 MolecularWeight: 422.48215

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)C(=CC=C2)[S+]3CCCC3.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCCOC1=CC2=C(C=C1)C(=CC=C2)[S+]3CCCC3.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C17H21OS.CHF3O3S/c1-2-10-18-15-8-9-16-14(13-15)6-5-7-17(16)19-11-3-4-12-19;2-1(3,4)8(5,6)7/h5-9,13H,2-4,10-12H2,1H3;(H,5,6,7)/q+1;/p-1