tert-butyl 2-[[2,2-bis(fluoranyl)-1,3-benzodioxol-4-yl]carbonyl]-3-cyclopropyl-3-oxidanylidene-propanoate

Systemtic Name: tert-butyl 2-[[2,2-bis(fluoranyl)-1,3-benzodioxol-4-yl]carbonyl]-3-cyclopropyl-3-oxidanylidene-propanoate Openeye Name: tert-butyl 2-(cyclopropanecarbonyl)-3-(2,2-difluoro-1,3-benzodioxol-4-yl)-3-oxo-propanoate CAS Name: 2-[cyclopropyl(oxo)methyl]-3-(2,2-difluoro-1,3-benzodioxol-4-yl)-3-oxopropanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-(cyclopropanecarbonyl)-3-(2,2-difluoro-1,3-benzodioxol-4-yl)-3-oxopropanoate Traditional Name: 2-(cyclopropanecarbonyl)-3-(2,2-difluoro-1,3-benzodioxol-4-yl)-3-keto-propionic acid tert-butyl ester Formula: C18H18F2O6 MolecularWeight: 368.328726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C(=O)C1CC1)C(=O)C2=C3C(=CC=C2)OC(O3)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)C(C(=O)C1CC1)C(=O)C2=C3C(=CC=C2)OC(O3)(F)F

InChI

InChI=1S/C18H18F2O6/c1-17(2,3)26-16(23)12(13(21)9-7-8-9)14(22)10-5-4-6-11-15(10)25-18(19,20)24-11/h4-6,9,12H,7-8H2,1-3H3