phenylsulfanyl 4-heptoxybenzoate pentafluoride

Systemtic Name: phenylsulfanyl 4-heptoxybenzoate pentafluoride Openeye Name: phenylsulfanyl 4-heptoxybenzoate pentafluoride CAS Name: 4-heptoxybenzoic acid (phenylthio) ester pentafluoride IUPAC Name: phenylsulfanyl 4-heptoxybenzoate pentafluoride Traditional Name: 4-heptoxybenzoic acid (phenylthio) ester pentafluoride Formula: C20H24F5O3S-5 MolecularWeight: 439.459776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)OSC2=CC=CC=C2.[F-].[F-].[F-].[F-].[F-]

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)OSC2=CC=CC=C2.[F-].[F-].[F-].[F-].[F-]

InChI

InChI=1S/C20H24O3S.5FH/c1-2-3-4-5-9-16-22-18-14-12-17(13-15-18)20(21)23-24-19-10-7-6-8-11-19;;;;;/h6-8,10-15H,2-5,9,16H2,1H3;5*1H/p-5