2-carboxy-1,1-bis(fluoranyl)-3,3-dimethyl-2-(trifluoromethyl)butane-1-sulfonate; triphenylsulfanium

Systemtic Name: 2-carboxy-1,1-bis(fluoranyl)-3,3-dimethyl-2-(trifluoromethyl)butane-1-sulfonate; triphenylsulfanium Openeye Name: 2-carboxy-1,1-difluoro-3,3-dimethyl-2-(trifluoromethyl)butane-1-sulfonate; triphenylsulfonium CAS Name: 2-carboxy-1,1-difluoro-3,3-dimethyl-2-(trifluoromethyl)-1-butanesulfonate; triphenylsulfonium IUPAC Name: 2-carboxy-1,1-difluoro-3,3-dimethyl-2-(trifluoromethyl)butane-1-sulfonate; triphenylsulfanium Traditional Name: 2-carboxy-1,1-difluoro-3,3-dimethyl-2-(trifluoromethyl)butane-1-sulfonate; triphenylsulfonium Formula: C26H25F5O5S2 MolecularWeight: 576.595716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15S.C8H11F5O5S/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-5(2,3)6(4(14)15,7(9,10)11)8(12,13)19(16,17)18/h1-15H;1-3H3,(H,14,15)(H,16,17,18)/q+1;/p-1