2-tert-butylsulfanyl-1-(2-phenylethynyl)cyclohexan-1-ol

Systemtic Name: 2-tert-butylsulfanyl-1-(2-phenylethynyl)cyclohexan-1-ol Openeye Name: 2-tert-butylsulfanyl-1-(2-phenylethynyl)cyclohexanol CAS Name: 2-(tert-butylthio)-1-(2-phenylethynyl)-1-cyclohexanol IUPAC Name: 2-tert-butylsulfanyl-1-(2-phenylethynyl)cyclohexan-1-ol Traditional Name: 2-(tert-butylthio)-1-(2-phenylethynyl)cyclohexanol Formula: C18H24OS MolecularWeight: 288.44756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC1CCCCC1(C#CC2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)SC1CCCCC1(C#CC2=CC=CC=C2)O

InChI

InChI=1S/C18H24OS/c1-17(2,3)20-16-11-7-8-13-18(16,19)14-12-15-9-5-4-6-10-15/h4-6,9-10,16,19H,7-8,11,13H2,1-3H3