trimethyl (2S,5S)-5-phenyl-2-[4-(trifluoromethyl)phenyl]-1,2-dihydropyrrole-3,4,5-tricarboxylate

Systemtic Name: trimethyl (2S,5S)-5-phenyl-2-[4-(trifluoromethyl)phenyl]-1,2-dihydropyrrole-3,4,5-tricarboxylate Openeye Name: trimethyl (2S,5S)-5-phenyl-2-[4-(trifluoromethyl)phenyl]-1,2-dihydropyrrole-3,4,5-tricarboxylate CAS Name: (2S,5S)-5-phenyl-2-[4-(trifluoromethyl)phenyl]-1,2-dihydropyrrole-3,4,5-tricarboxylic acid trimethyl ester IUPAC Name: trimethyl (2S,5S)-5-phenyl-2-[4-(trifluoromethyl)phenyl]-1,2-dihydropyrrole-3,4,5-tricarboxylate Traditional Name: (2S,5S)-2-phenyl-5-[4-(trifluoromethyl)phenyl]-3-pyrroline-2,3,4-tricarboxylic acid trimethyl ester Formula: C23H20F3NO6 MolecularWeight: 463.40321

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(NC1C2=CC=C(C=C2)C(F)(F)F)(C3=CC=CC=C3)C(=O)OC)C(=O)OC

Isomeric SMILES

COC(=O)C1=C([C@@](N[C@H]1C2=CC=C(C=C2)C(F)(F)F)(C3=CC=CC=C3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C23H20F3NO6/c1-31-19(28)16-17(20(29)32-2)22(21(30)33-3,14-7-5-4-6-8-14)27-18(16)13-9-11-15(12-10-13)23(24,25)26/h4-12,18,27H,1-3H3/t18-,22-/m0/s1