(phenylmethyl) (2S,3aS,6aS)-1-[(2S)-2-[2,2,2-tris(fluoranyl)ethanoylamino]propanoyl]-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole-2-carboxylate

Systemtic Name: (phenylmethyl) (2S,3aS,6aS)-1-[(2S)-2-[2,2,2-tris(fluoranyl)ethanoylamino]propanoyl]-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole-2-carboxylate Openeye Name: benzyl (2S,3aS,6aS)-1-[(2S)-2-[(2,2,2-trifluoroacetyl)amino]propanoyl]-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole-2-carboxylate CAS Name: (2S,3aS,6aS)-1-[(2S)-1-oxo-2-[(2,2,2-trifluoro-1-oxoethyl)amino]propyl]-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3aS,6aS)-1-[(2S)-2-[(2,2,2-trifluoroacetyl)amino]propanoyl]-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole-2-carboxylate Traditional Name: (2S,3aS,6aS)-1-[(2S)-2-[(2,2,2-trifluoroacetyl)amino]propanoyl]-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole-2-carboxylic acid benzyl ester Formula: C20H23F3N2O4 MolecularWeight: 412.40283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2CCCC2CC1C(=O)OCC3=CC=CC=C3)NC(=O)C(F)(F)F

Isomeric SMILES

C[C@@H](C(=O)N1[C@H]2CCC[C@H]2C[C@H]1C(=O)OCC3=CC=CC=C3)NC(=O)C(F)(F)F

InChI

InChI=1S/C20H23F3N2O4/c1-12(24-19(28)20(21,22)23)17(26)25-15-9-5-8-14(15)10-16(25)18(27)29-11-13-6-3-2-4-7-13/h2-4,6-7,12,14-16H,5,8-11H2,1H3,(H,24,28)/t12-,14-,15-,16-/m0/s1