pentan-2-yl (2S)-1-[2,2,2-tris(fluoranyl)ethanoyl]pyrrolidine-2-carboxylate

Systemtic Name: pentan-2-yl (2S)-1-[2,2,2-tris(fluoranyl)ethanoyl]pyrrolidine-2-carboxylate Openeye Name: 1-methylbutyl (2S)-1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-(2,2,2-trifluoro-1-oxoethyl)-2-pyrrolidinecarboxylic acid pentan-2-yl ester IUPAC Name: pentan-2-yl (2S)-1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carboxylic acid 1-methylbutyl ester Formula: C12H18F3NO3 MolecularWeight: 281.27143

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)OC(=O)C1CCCN1C(=O)C(F)(F)F

Isomeric SMILES

CCCC(C)OC(=O)[C@@H]1CCCN1C(=O)C(F)(F)F

InChI

InChI=1S/C12H18F3NO3/c1-3-5-8(2)19-10(17)9-6-4-7-16(9)11(18)12(13,14)15/h8-9H,3-7H2,1-2H3/t8?,9-/m0/s1