methyl 4-[(3R,4R)-3,4-bis(trifluoromethylsulfonylamino)pyrrolidin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[(3R,4R)-3,4-bis(trifluoromethylsulfonylamino)pyrrolidin-1-yl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[(3R,4R)-3,4-bis(trifluoromethylsulfonylamino)pyrrolidin-1-yl]-4-oxo-butanoate CAS Name: 4-[(3R,4R)-3,4-bis(trifluoromethylsulfonylamino)-1-pyrrolidinyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[(3R,4R)-3,4-bis(trifluoromethylsulfonylamino)pyrrolidin-1-yl]-4-oxobutanoate Traditional Name: 4-[(3R,4R)-3,4-bis(triflylamino)pyrrolidino]-4-keto-butyric acid methyl ester Formula: C11H15F6N3O7S2 MolecularWeight: 479.373119

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)N1CC(C(C1)NS(=O)(=O)C(F)(F)F)NS(=O)(=O)C(F)(F)F

Isomeric SMILES

COC(=O)CCC(=O)N1C[C@H]([C@@H](C1)NS(=O)(=O)C(F)(F)F)NS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C11H15F6N3O7S2/c1-27-9(22)3-2-8(21)20-4-6(18-28(23,24)10(12,13)14)7(5-20)19-29(25,26)11(15,16)17/h6-7,18-19H,2-5H2,1H3/t6-,7-/m1/s1