1,1,1-tris(fluoranyl)-2-methyl-4-[4-(phenylsulfonyl)phenyl]but-3-yn-2-ol

Systemtic Name: 1,1,1-tris(fluoranyl)-2-methyl-4-[4-(phenylsulfonyl)phenyl]but-3-yn-2-ol Openeye Name: 4-[4-(benzenesulfonyl)phenyl]-1,1,1-trifluoro-2-methyl-but-3-yn-2-ol CAS Name: 4-[4-(benzenesulfonyl)phenyl]-1,1,1-trifluoro-2-methyl-3-butyn-2-ol IUPAC Name: 4-[4-(benzenesulfonyl)phenyl]-1,1,1-trifluoro-2-methylbut-3-yn-2-ol Traditional Name: 4-(4-besylphenyl)-1,1,1-trifluoro-2-methyl-but-3-yn-2-ol Formula: C17H13F3O3S MolecularWeight: 354.34353

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2)(C(F)(F)F)O

Isomeric SMILES

CC(C#CC1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2)(C(F)(F)F)O

InChI

InChI=1S/C17H13F3O3S/c1-16(21,17(18,19)20)12-11-13-7-9-15(10-8-13)24(22,23)14-5-3-2-4-6-14/h2-10,21H,1H3