1-heptyl-4-(2-phenylsulfanylethyl)benzene pentafluoride

Systemtic Name: 1-heptyl-4-(2-phenylsulfanylethyl)benzene pentafluoride Openeye Name: 1-heptyl-4-(2-phenylsulfanylethyl)benzene pentafluoride CAS Name: 1-heptyl-4-[2-(phenylthio)ethyl]benzene pentafluoride IUPAC Name: 1-heptyl-4-(2-phenylsulfanylethyl)benzene pentafluoride Traditional Name: 1-heptyl-4-[2-(phenylthio)ethyl]benzene pentafluoride Formula: C21H28F5S-5 MolecularWeight: 407.504036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)CCSC2=CC=CC=C2.[F-].[F-].[F-].[F-].[F-]

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)CCSC2=CC=CC=C2.[F-].[F-].[F-].[F-].[F-]

InChI

InChI=1S/C21H28S.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;;;;;/h6,8-9,11-16H,2-5,7,10,17-18H2,1H3;5*1H/p-5