1-hexyl-4-(4-phenylsulfanylcyclohex-3-en-1-yl)benzene pentafluoride

Systemtic Name: 1-hexyl-4-(4-phenylsulfanylcyclohex-3-en-1-yl)benzene pentafluoride Openeye Name: 1-hexyl-4-(4-phenylsulfanylcyclohex-3-en-1-yl)benzene pentafluoride CAS Name: 1-hexyl-4-[4-(phenylthio)-1-cyclohex-3-enyl]benzene pentafluoride IUPAC Name: 1-hexyl-4-(4-phenylsulfanylcyclohex-3-en-1-yl)benzene pentafluoride Traditional Name: 1-hexyl-4-[4-(phenylthio)cyclohex-3-en-1-yl]benzene pentafluoride Formula: C24H30F5S-5 MolecularWeight: 445.552016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2CCC(=CC2)SC3=CC=CC=C3.[F-].[F-].[F-].[F-].[F-]

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2CCC(=CC2)SC3=CC=CC=C3.[F-].[F-].[F-].[F-].[F-]

InChI

InChI=1S/C24H30S.5FH/c1-2-3-4-6-9-20-12-14-21(15-13-20)22-16-18-24(19-17-22)25-23-10-7-5-8-11-23;;;;;/h5,7-8,10-15,18,22H,2-4,6,9,16-17,19H2,1H3;5*1H/p-5