(2-chlorophenyl)sulfanyl 4-heptylbenzoate pentafluoride

Systemtic Name: (2-chlorophenyl)sulfanyl 4-heptylbenzoate pentafluoride Openeye Name: (2-chlorophenyl)sulfanyl 4-heptylbenzoate pentafluoride CAS Name: 4-heptylbenzoic acid [(2-chlorophenyl)thio] ester pentafluoride IUPAC Name: (2-chlorophenyl)sulfanyl 4-heptylbenzoate pentafluoride Traditional Name: 4-heptylbenzoic acid [(2-chlorophenyl)thio] ester pentafluoride Formula: C20H23ClF5O2S-5 MolecularWeight: 457.905436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C(=O)OSC2=CC=CC=C2Cl.[F-].[F-].[F-].[F-].[F-]

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C(=O)OSC2=CC=CC=C2Cl.[F-].[F-].[F-].[F-].[F-]

InChI

InChI=1S/C20H23ClO2S.5FH/c1-2-3-4-5-6-9-16-12-14-17(15-13-16)20(22)23-24-19-11-8-7-10-18(19)21;;;;;/h7-8,10-15H,2-6,9H2,1H3;5*1H/p-5