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

Systemtic Name: 1-(6-phenylmethoxynaphthalen-1-yl)thiolan-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: 1-(6-benzyloxy-1-naphthyl)tetrahydrothiophen-1-ium; trifluoromethanesulfonate CAS Name: 1-(6-phenylmethoxy-1-naphthalenyl)thiolan-1-ium; trifluoromethanesulfonate IUPAC Name: 1-(6-phenylmethoxynaphthalen-1-yl)thiolan-1-ium; trifluoromethanesulfonate Traditional Name: 1-(6-benzoxy-1-naphthyl)tetrahydrothiophen-1-ium triflate Formula: C22H21F3O4S2 MolecularWeight: 470.52495

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[S+](C1)C2=CC=CC3=C2C=CC(=C3)OCC4=CC=CC=C4.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1CC[S+](C1)C2=CC=CC3=C2C=CC(=C3)OCC4=CC=CC=C4.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C21H21OS.CHF3O3S/c1-2-7-17(8-3-1)16-22-19-11-12-20-18(15-19)9-6-10-21(20)23-13-4-5-14-23;2-1(3,4)8(5,6)7/h1-3,6-12,15H,4-5,13-14,16H2;(H,5,6,7)/q+1;/p-1