4,4,4-tris(fluoranyl)-2-methyl-1-(4-methylsulfonylphenyl)butane-1,2-diol

Systemtic Name: 4,4,4-tris(fluoranyl)-2-methyl-1-(4-methylsulfonylphenyl)butane-1,2-diol Openeye Name: 4,4,4-trifluoro-2-methyl-1-(4-methylsulfonylphenyl)butane-1,2-diol CAS Name: 4,4,4-trifluoro-2-methyl-1-(4-methylsulfonylphenyl)butane-1,2-diol IUPAC Name: 4,4,4-trifluoro-2-methyl-1-(4-methylsulfonylphenyl)butane-1,2-diol Traditional Name: 4,4,4-trifluoro-1-(4-mesylphenyl)-2-methyl-butane-1,2-diol Formula: C12H15F3O4S MolecularWeight: 312.30531

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(F)(F)F)(C(C1=CC=C(C=C1)S(=O)(=O)C)O)O

Isomeric SMILES

CC(CC(F)(F)F)(C(C1=CC=C(C=C1)S(=O)(=O)C)O)O

InChI

InChI=1S/C12H15F3O4S/c1-11(17,7-12(13,14)15)10(16)8-3-5-9(6-4-8)20(2,18)19/h3-6,10,16-17H,7H2,1-2H3