phenylsulfanyl 4-(4-hexoxycyclohexyl)benzoate pentafluoride

Systemtic Name: phenylsulfanyl 4-(4-hexoxycyclohexyl)benzoate pentafluoride Openeye Name: phenylsulfanyl 4-(4-hexoxycyclohexyl)benzoate pentafluoride CAS Name: 4-(4-hexoxycyclohexyl)benzoic acid (phenylthio) ester pentafluoride IUPAC Name: phenylsulfanyl 4-(4-hexoxycyclohexyl)benzoate pentafluoride Traditional Name: 4-(4-hexoxycyclohexyl)benzoic acid (phenylthio) ester pentafluoride Formula: C25H32F5O3S-5 MolecularWeight: 507.576796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1CCC(CC1)C2=CC=C(C=C2)C(=O)OSC3=CC=CC=C3.[F-].[F-].[F-].[F-].[F-]

Isomeric SMILES

CCCCCCOC1CCC(CC1)C2=CC=C(C=C2)C(=O)OSC3=CC=CC=C3.[F-].[F-].[F-].[F-].[F-]

InChI

InChI=1S/C25H32O3S.5FH/c1-2-3-4-8-19-27-23-17-15-21(16-18-23)20-11-13-22(14-12-20)25(26)28-29-24-9-6-5-7-10-24;;;;;/h5-7,9-14,21,23H,2-4,8,15-19H2,1H3;5*1H/p-5