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

Systemtic Name: 1-pentyl-4-(4-phenylsulfanylcyclohex-3-en-1-yl)benzene pentafluoride Openeye Name: 1-pentyl-4-(4-phenylsulfanylcyclohex-3-en-1-yl)benzene pentafluoride CAS Name: 1-pentyl-4-[4-(phenylthio)-1-cyclohex-3-enyl]benzene pentafluoride IUPAC Name: 1-pentyl-4-(4-phenylsulfanylcyclohex-3-en-1-yl)benzene pentafluoride Traditional Name: 1-amyl-4-[4-(phenylthio)cyclohex-3-en-1-yl]benzene pentafluoride Formula: C23H28F5S-5 MolecularWeight: 431.525436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2CCC(=CC2)SC3=CC=CC=C3.[F-].[F-].[F-].[F-].[F-]

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2CCC(=CC2)SC3=CC=CC=C3.[F-].[F-].[F-].[F-].[F-]

InChI

InChI=1S/C23H28S.5FH/c1-2-3-5-8-19-11-13-20(14-12-19)21-15-17-23(18-16-21)24-22-9-6-4-7-10-22;;;;;/h4,6-7,9-14,17,21H,2-3,5,8,15-16,18H2,1H3;5*1H/p-5