1-[bis[[3,5-bis(trifluoromethyl)phenyl]sulfanyl]methyl]cyclohex-2-en-1-ol

Systemtic Name: 1-[bis[[3,5-bis(trifluoromethyl)phenyl]sulfanyl]methyl]cyclohex-2-en-1-ol Openeye Name: 1-[bis[[3,5-bis(trifluoromethyl)phenyl]sulfanyl]methyl]cyclohex-2-en-1-ol CAS Name: 1-[bis[[3,5-bis(trifluoromethyl)phenyl]thio]methyl]-1-cyclohex-2-enol IUPAC Name: 1-[bis[[3,5-bis(trifluoromethyl)phenyl]sulfanyl]methyl]cyclohex-2-en-1-ol Traditional Name: 1-[bis[[3,5-bis(trifluoromethyl)phenyl]thio]methyl]cyclohex-2-en-1-ol Formula: C23H16F12OS2 MolecularWeight: 600.483378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC=CC(C1)(C(SC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)SC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)O

Isomeric SMILES

C1CC=CC(C1)(C(SC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)SC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)O

InChI

InChI=1S/C23H16F12OS2/c24-20(25,26)12-6-13(21(27,28)29)9-16(8-12)37-18(19(36)4-2-1-3-5-19)38-17-10-14(22(30,31)32)7-15(11-17)23(33,34)35/h2,4,6-11,18,36H,1,3,5H2