diethyl (2S,4R)-1-(phenylmethyl)-4-[2,2,2-tris(fluoranyl)ethanoylamino]pyrrolidine-2,4-dicarboxylate

Systemtic Name: diethyl (2S,4R)-1-(phenylmethyl)-4-[2,2,2-tris(fluoranyl)ethanoylamino]pyrrolidine-2,4-dicarboxylate Openeye Name: diethyl (2S,4R)-1-benzyl-4-[(2,2,2-trifluoroacetyl)amino]pyrrolidine-2,4-dicarboxylate CAS Name: (2S,4R)-1-(phenylmethyl)-4-[(2,2,2-trifluoro-1-oxoethyl)amino]pyrrolidine-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl (2S,4R)-1-benzyl-4-[(2,2,2-trifluoroacetyl)amino]pyrrolidine-2,4-dicarboxylate Traditional Name: (2S,4R)-1-benzyl-4-[(2,2,2-trifluoroacetyl)amino]pyrrolidine-2,4-dicarboxylic acid diethyl ester Formula: C19H23F3N2O5 MolecularWeight: 416.39153

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(CN1CC2=CC=CC=C2)(C(=O)OCC)NC(=O)C(F)(F)F

Isomeric SMILES

CCOC(=O)[C@@H]1C[C@@](CN1CC2=CC=CC=C2)(C(=O)OCC)NC(=O)C(F)(F)F

InChI

InChI=1S/C19H23F3N2O5/c1-3-28-15(25)14-10-18(17(27)29-4-2,23-16(26)19(20,21)22)12-24(14)11-13-8-6-5-7-9-13/h5-9,14H,3-4,10-12H2,1-2H3,(H,23,26)/t14-,18+/m0/s1