ethyl (2S)-5-oxidanylidene-1-[1,1,1-tris(fluoranyl)-3-nitro-propan-2-yl]pyrrolidine-2-carboxylate

Systemtic Name: ethyl (2S)-5-oxidanylidene-1-[1,1,1-tris(fluoranyl)-3-nitro-propan-2-yl]pyrrolidine-2-carboxylate Openeye Name: ethyl (2S)-5-oxo-1-[2,2,2-trifluoro-1-(nitromethyl)ethyl]pyrrolidine-2-carboxylate CAS Name: (2S)-5-oxo-1-(1,1,1-trifluoro-3-nitropropan-2-yl)-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S)-5-oxo-1-(1,1,1-trifluoro-3-nitropropan-2-yl)pyrrolidine-2-carboxylate Traditional Name: (2S)-5-keto-1-[2,2,2-trifluoro-1-(nitromethyl)ethyl]pyrrolidine-2-carboxylic acid ethyl ester Formula: C10H13F3N2O5 MolecularWeight: 298.21583

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(=O)N1C(C[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CCOC(=O)[C@@H]1CCC(=O)N1C(C[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C10H13F3N2O5/c1-2-20-9(17)6-3-4-8(16)15(6)7(5-14(18)19)10(11,12)13/h6-7H,2-5H2,1H3/t6-,7?/m0/s1