4-[4-[4-[2-(1-oxidanylcyclohexyl)ethynyl]phenoxy]phenyl]sulfonylphenol

Systemtic Name: 4-[4-[4-[2-(1-oxidanylcyclohexyl)ethynyl]phenoxy]phenyl]sulfonylphenol Openeye Name: 4-[4-[4-[2-(1-hydroxycyclohexyl)ethynyl]phenoxy]phenyl]sulfonylphenol CAS Name: 4-[4-[4-[2-(1-hydroxycyclohexyl)ethynyl]phenoxy]phenyl]sulfonylphenol IUPAC Name: 4-[4-[4-[2-(1-hydroxycyclohexyl)ethynyl]phenoxy]phenyl]sulfonylphenol Traditional Name: 4-[4-[4-[2-(1-hydroxycyclohexyl)ethynyl]phenoxy]phenyl]sulfonylphenol Formula: C26H24O5S MolecularWeight: 448.53076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#CC2=CC=C(C=C2)OC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)O)O

Isomeric SMILES

C1CCC(CC1)(C#CC2=CC=C(C=C2)OC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)O)O

InChI

InChI=1S/C26H24O5S/c27-21-6-12-24(13-7-21)32(29,30)25-14-10-23(11-15-25)31-22-8-4-20(5-9-22)16-19-26(28)17-2-1-3-18-26/h4-15,27-28H,1-3,17-18H2