2,4-bis(fluoranyl)benzenesulfonate; 1-(4-butoxynaphthalen-1-yl)thiolan-1-ium

Systemtic Name: 2,4-bis(fluoranyl)benzenesulfonate; 1-(4-butoxynaphthalen-1-yl)thiolan-1-ium Openeye Name: 1-(4-butoxy-1-naphthyl)tetrahydrothiophen-1-ium; 2,4-difluorobenzenesulfonate CAS Name: 1-(4-butoxy-1-naphthalenyl)thiolan-1-ium; 2,4-difluorobenzenesulfonate IUPAC Name: 1-(4-butoxynaphthalen-1-yl)thiolan-1-ium; 2,4-difluorobenzenesulfonate Traditional Name: 1-(4-butoxy-1-naphthyl)tetrahydrothiophen-1-ium; 2,4-difluorobesylate Formula: C24H26F2O4S2 MolecularWeight: 480.587646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C2=CC=CC=C21)[S+]3CCCC3.C1=CC(=C(C=C1F)F)S(=O)(=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C2=CC=CC=C21)[S+]3CCCC3.C1=CC(=C(C=C1F)F)S(=O)(=O)[O-]

InChI

InChI=1S/C18H23OS.C6H4F2O3S/c1-2-3-12-19-17-10-11-18(20-13-6-7-14-20)16-9-5-4-8-15(16)17;7-4-1-2-6(5(8)3-4)12(9,10)11/h4-5,8-11H,2-3,6-7,12-14H2,1H3;1-3H,(H,9,10,11)/q+1;/p-1