S-[4-(4-octylcyclohexyl)phenyl] 4-[bis(fluoranyl)methyl]benzenecarbothioate

Systemtic Name: S-[4-(4-octylcyclohexyl)phenyl] 4-[bis(fluoranyl)methyl]benzenecarbothioate Openeye Name: S-[4-(4-octylcyclohexyl)phenyl] 4-(difluoromethyl)benzenecarbothioate CAS Name: 4-(difluoromethyl)benzenecarbothioic acid S-[4-(4-octylcyclohexyl)phenyl] ester IUPAC Name: S-[4-(4-octylcyclohexyl)phenyl] 4-(difluoromethyl)benzenecarbothioate Traditional Name: 4-(difluoromethyl)thiobenzoic acid S-[4-(4-octylcyclohexyl)phenyl] ester Formula: C28H36F2OS MolecularWeight: 458.646646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C2=CC=C(C=C2)SC(=O)C3=CC=C(C=C3)C(F)F

Isomeric SMILES

CCCCCCCCC1CCC(CC1)C2=CC=C(C=C2)SC(=O)C3=CC=C(C=C3)C(F)F

InChI

InChI=1S/C28H36F2OS/c1-2-3-4-5-6-7-8-21-9-11-22(12-10-21)23-17-19-26(20-18-23)32-28(31)25-15-13-24(14-16-25)27(29)30/h13-22,27H,2-12H2,1H3