(3S)-1-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (3S)-1-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3S)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3S)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-keto-pyrrolidine-3-carboxylate Formula: C12H8F2NO5- MolecularWeight: 284.192426

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1C(=O)[O-])C2=CC3=C(C=C2)OC(O3)(F)F

Isomeric SMILES

C1CN(C(=O)[C@H]1C(=O)[O-])C2=CC3=C(C=C2)OC(O3)(F)F

InChI

InChI=1S/C12H9F2NO5/c13-12(14)19-8-2-1-6(5-9(8)20-12)15-4-3-7(10(15)16)11(17)18/h1-2,5,7H,3-4H2,(H,17,18)/p-1/t7-/m0/s1