(2-fluorophenyl)sulfanyl 4-pentylbenzoate pentafluoride

Systemtic Name: (2-fluorophenyl)sulfanyl 4-pentylbenzoate pentafluoride Openeye Name: (2-fluorophenyl)sulfanyl 4-pentylbenzoate pentafluoride CAS Name: 4-pentylbenzoic acid [(2-fluorophenyl)thio] ester pentafluoride IUPAC Name: (2-fluorophenyl)sulfanyl 4-pentylbenzoate pentafluoride Traditional Name: 4-amylbenzoic acid [(2-fluorophenyl)thio] ester pentafluoride Formula: C18H19F6O2S-5 MolecularWeight: 413.397679

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)OSC2=CC=CC=C2F.[F-].[F-].[F-].[F-].[F-]

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)OSC2=CC=CC=C2F.[F-].[F-].[F-].[F-].[F-]

InChI

InChI=1S/C18H19FO2S.5FH/c1-2-3-4-7-14-10-12-15(13-11-14)18(20)21-22-17-9-6-5-8-16(17)19;;;;;/h5-6,8-13H,2-4,7H2,1H3;5*1H/p-5