4-methyl-5-(4-methylsulfonylphenyl)-4-[2,2,2-tris(fluoranyl)ethyl]-3,6-dioxabicyclo[3.1.0]hexan-2-one

Systemtic Name: 4-methyl-5-(4-methylsulfonylphenyl)-4-[2,2,2-tris(fluoranyl)ethyl]-3,6-dioxabicyclo[3.1.0]hexan-2-one Openeye Name: 4-methyl-5-(4-methylsulfonylphenyl)-4-(2,2,2-trifluoroethyl)-3,6-dioxabicyclo[3.1.0]hexan-2-one CAS Name: 4-methyl-5-(4-methylsulfonylphenyl)-4-(2,2,2-trifluoroethyl)-3,6-dioxabicyclo[3.1.0]hexan-2-one IUPAC Name: 4-methyl-5-(4-methylsulfonylphenyl)-4-(2,2,2-trifluoroethyl)-3,6-dioxabicyclo[3.1.0]hexan-2-one Traditional Name: 5-(4-mesylphenyl)-4-methyl-4-(2,2,2-trifluoroethyl)-3,6-dioxabicyclo[3.1.0]hexan-2-one Formula: C14H13F3O5S MolecularWeight: 350.31023

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2(C(O2)C(=O)O1)C3=CC=C(C=C3)S(=O)(=O)C)CC(F)(F)F

Isomeric SMILES

CC1(C2(C(O2)C(=O)O1)C3=CC=C(C=C3)S(=O)(=O)C)CC(F)(F)F

InChI

InChI=1S/C14H13F3O5S/c1-12(7-13(15,16)17)14(10(21-14)11(18)22-12)8-3-5-9(6-4-8)23(2,19)20/h3-6,10H,7H2,1-2H3