3,3-dimethyl-6-[1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butylsulfonyloxy]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 3,3-dimethyl-6-[1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butylsulfonyloxy]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 3,3-dimethyl-6-(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyloxy)-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 3,3-dimethyl-6-(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyloxy)-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 3,3-dimethyl-6-(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyloxy)-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 7-keto-3,3-dimethyl-6-(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyloxy)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C12H10F9NO6S2 MolecularWeight: 499.326529

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)OS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(=O)O)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)OS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(=O)O)C

InChI

InChI=1S/C12H10F9NO6S2/c1-8(2)4(7(24)25)22-5(23)3(6(22)29-8)28-30(26,27)12(20,21)10(15,16)9(13,14)11(17,18)19/h3-4,6H,1-2H3,(H,24,25)