2-(4-heptylcyclohexyl)ethynylsulfanylbenzene pentafluoride

Systemtic Name: 2-(4-heptylcyclohexyl)ethynylsulfanylbenzene pentafluoride Openeye Name: 2-(4-heptylcyclohexyl)ethynylsulfanylbenzene pentafluoride CAS Name: [2-(4-heptylcyclohexyl)ethynylthio]benzene pentafluoride IUPAC Name: 2-(4-heptylcyclohexyl)ethynylsulfanylbenzene pentafluoride Traditional Name: [2-(4-heptylcyclohexyl)ethynylthio]benzene pentafluoride Formula: C21H30F5S-5 MolecularWeight: 409.519916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C#CSC2=CC=CC=C2.[F-].[F-].[F-].[F-].[F-]

Isomeric SMILES

CCCCCCCC1CCC(CC1)C#CSC2=CC=CC=C2.[F-].[F-].[F-].[F-].[F-]

InChI

InChI=1S/C21H30S.5FH/c1-2-3-4-5-7-10-19-13-15-20(16-14-19)17-18-22-21-11-8-6-9-12-21;;;;;/h6,8-9,11-12,19-20H,2-5,7,10,13-16H2,1H3;5*1H/p-5