phenylsulfanyl 4-heptylbenzoate pentafluoride

Systemtic Name: phenylsulfanyl 4-heptylbenzoate pentafluoride Openeye Name: phenylsulfanyl 4-heptylbenzoate pentafluoride CAS Name: 4-heptylbenzoic acid (phenylthio) ester pentafluoride IUPAC Name: phenylsulfanyl 4-heptylbenzoate pentafluoride Traditional Name: 4-heptylbenzoic acid (phenylthio) ester pentafluoride Formula: C20H24F5O2S-5 MolecularWeight: 423.460376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C(=O)OSC2=CC=CC=C2.[F-].[F-].[F-].[F-].[F-]

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C(=O)OSC2=CC=CC=C2.[F-].[F-].[F-].[F-].[F-]

InChI

InChI=1S/C20H24O2S.5FH/c1-2-3-4-5-7-10-17-13-15-18(16-14-17)20(21)22-23-19-11-8-6-9-12-19;;;;;/h6,8-9,11-16H,2-5,7,10H2,1H3;5*1H/p-5