2-(4-heptoxycyclohexyl)ethynylsulfanylbenzene pentafluoride

Systemtic Name: 2-(4-heptoxycyclohexyl)ethynylsulfanylbenzene pentafluoride Openeye Name: 2-(4-heptoxycyclohexyl)ethynylsulfanylbenzene pentafluoride CAS Name: [2-(4-heptoxycyclohexyl)ethynylthio]benzene pentafluoride IUPAC Name: 2-(4-heptoxycyclohexyl)ethynylsulfanylbenzene pentafluoride Traditional Name: [2-(4-heptoxycyclohexyl)ethynylthio]benzene pentafluoride Formula: C21H30F5OS-5 MolecularWeight: 425.519316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1CCC(CC1)C#CSC2=CC=CC=C2.[F-].[F-].[F-].[F-].[F-]

Isomeric SMILES

CCCCCCCOC1CCC(CC1)C#CSC2=CC=CC=C2.[F-].[F-].[F-].[F-].[F-]

InChI

InChI=1S/C21H30OS.5FH/c1-2-3-4-5-9-17-22-20-14-12-19(13-15-20)16-18-23-21-10-7-6-8-11-21;;;;;/h6-8,10-11,19-20H,2-5,9,12-15,17H2,1H3;5*1H/p-5