[3-(4-methylsulfonylphenyl)-4-[4-(trifluoromethyl)phenyl]cyclopenten-1-yl]methanediol

Systemtic Name: [3-(4-methylsulfonylphenyl)-4-[4-(trifluoromethyl)phenyl]cyclopenten-1-yl]methanediol Openeye Name: [3-(4-methylsulfonylphenyl)-4-[4-(trifluoromethyl)phenyl]cyclopenten-1-yl]methanediol CAS Name: [3-(4-methylsulfonylphenyl)-4-[4-(trifluoromethyl)phenyl]-1-cyclopentenyl]methanediol IUPAC Name: [3-(4-methylsulfonylphenyl)-4-[4-(trifluoromethyl)phenyl]cyclopenten-1-yl]methanediol Traditional Name: [3-(4-mesylphenyl)-4-[4-(trifluoromethyl)phenyl]cyclopenten-1-yl]methanediol Formula: C20H19F3O4S MolecularWeight: 412.42267

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2C=C(CC2C3=CC=C(C=C3)C(F)(F)F)C(O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2C=C(CC2C3=CC=C(C=C3)C(F)(F)F)C(O)O

InChI

InChI=1S/C20H19F3O4S/c1-28(26,27)16-8-4-13(5-9-16)18-11-14(19(24)25)10-17(18)12-2-6-15(7-3-12)20(21,22)23/h2-9,11,17-19,24-25H,10H2,1H3