[ethyl(propan-2-yloxy)phosphoryl]methyl 4-fluoranyl-2-(trifluoromethylsulfanyl)benzenesulfonate

Systemtic Name: [ethyl(propan-2-yloxy)phosphoryl]methyl 4-fluoranyl-2-(trifluoromethylsulfanyl)benzenesulfonate Openeye Name: [ethyl(isopropoxy)phosphoryl]methyl 4-fluoro-2-(trifluoromethylsulfanyl)benzenesulfonate CAS Name: 4-fluoro-2-(trifluoromethylthio)benzenesulfonic acid [ethyl(propan-2-yloxy)phosphoryl]methyl ester IUPAC Name: [ethyl(propan-2-yloxy)phosphoryl]methyl 4-fluoro-2-(trifluoromethylsulfanyl)benzenesulfonate Traditional Name: 4-fluoro-2-(trifluoromethylthio)benzenesulfonic acid [ethyl(isopropoxy)phosphoryl]methyl ester Formula: C13H17F4O5PS2 MolecularWeight: 424.368454

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Descriptors Computed from Structure

Canonical SMILES:

CCP(=O)(COS(=O)(=O)C1=C(C=C(C=C1)F)SC(F)(F)F)OC(C)C

Isomeric SMILES

CCP(=O)(COS(=O)(=O)C1=C(C=C(C=C1)F)SC(F)(F)F)OC(C)C

InChI

InChI=1S/C13H17F4O5PS2/c1-4-23(18,22-9(2)3)8-21-25(19,20)12-6-5-10(14)7-11(12)24-13(15,16)17/h5-7,9H,4,8H2,1-3H3