phenylsulfanyl 4-pentylbenzoate pentafluoride

Systemtic Name: phenylsulfanyl 4-pentylbenzoate pentafluoride Openeye Name: phenylsulfanyl 4-pentylbenzoate pentafluoride CAS Name: 4-pentylbenzoic acid (phenylthio) ester pentafluoride IUPAC Name: phenylsulfanyl 4-pentylbenzoate pentafluoride Traditional Name: 4-amylbenzoic acid (phenylthio) ester pentafluoride Formula: C18H20F5O2S-5 MolecularWeight: 395.407216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)OSC2=CC=CC=C2.[F-].[F-].[F-].[F-].[F-]

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)OSC2=CC=CC=C2.[F-].[F-].[F-].[F-].[F-]

InChI

InChI=1S/C18H20O2S.5FH/c1-2-3-5-8-15-11-13-16(14-12-15)18(19)20-21-17-9-6-4-7-10-17;;;;;/h4,6-7,9-14H,2-3,5,8H2,1H3;5*1H/p-5