tert-butyl (Z)-3-[(4R,4aS,7R,7aR)-2,2-dimethyl-6-oxidanylidene-7-(trifluoromethylsulfonyloxy)-4,4a,7,7a-tetrahydrofuro[3,2-d][1,3]dioxin-4-yl]prop-2-enoate

Systemtic Name: tert-butyl (Z)-3-[(4R,4aS,7R,7aR)-2,2-dimethyl-6-oxidanylidene-7-(trifluoromethylsulfonyloxy)-4,4a,7,7a-tetrahydrofuro[3,2-d][1,3]dioxin-4-yl]prop-2-enoate Openeye Name: tert-butyl (Z)-3-[(4R,4aS,7R,7aR)-2,2-dimethyl-6-oxo-7-(trifluoromethylsulfonyloxy)-4,4a,7,7a-tetrahydrofuro[3,2-d][1,3]dioxin-4-yl]prop-2-enoate CAS Name: (Z)-3-[(4R,4aS,7R,7aR)-2,2-dimethyl-6-oxo-7-(trifluoromethylsulfonyloxy)-4,4a,7,7a-tetrahydrofuro[3,2-d][1,3]dioxin-4-yl]-2-propenoic acid tert-butyl ester IUPAC Name: tert-butyl (Z)-3-[(4R,4aS,7R,7aR)-2,2-dimethyl-6-oxo-7-(trifluoromethylsulfonyloxy)-4,4a,7,7a-tetrahydrofuro[3,2-d][1,3]dioxin-4-yl]prop-2-enoate Traditional Name: (Z)-3-[(4R,4aS,7R,7aR)-6-keto-2,2-dimethyl-7-triflyloxy-4,4a,7,7a-tetrahydrofuro[3,2-d][1,3]dioxin-4-yl]acrylic acid tert-butyl ester Formula: C16H21F3O9S MolecularWeight: 446.39275

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(C2C(O1)C(C(=O)O2)OS(=O)(=O)C(F)(F)F)C=CC(=O)OC(C)(C)C)C

Isomeric SMILES

CC1(O[C@@H]([C@H]2[C@@H](O1)[C@H](C(=O)O2)OS(=O)(=O)C(F)(F)F)/C=C\C(=O)OC(C)(C)C)C

InChI

InChI=1S/C16H21F3O9S/c1-14(2,3)26-9(20)7-6-8-10-11(27-15(4,5)25-8)12(13(21)24-10)28-29(22,23)16(17,18)19/h6-8,10-12H,1-5H3/b7-6-/t8-,10+,11-,12-/m1/s1