(3S)-1-(4-nitrophenyl)-5-oxidanylidene-N-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-(4-nitrophenyl)-5-oxidanylidene-N-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide Openeye Name: (3S)-1-(4-nitrophenyl)-5-oxo-N-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide CAS Name: (3S)-1-(4-nitrophenyl)-5-oxo-N-[3-(trifluoromethyl)phenyl]-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-(4-nitrophenyl)-5-oxo-N-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide Traditional Name: (3S)-5-keto-1-(4-nitrophenyl)-N-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide Formula: C18H14F3N3O4 MolecularWeight: 393.31667

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1[C@@H](CN(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H14F3N3O4/c19-18(20,21)12-2-1-3-13(9-12)22-17(26)11-8-16(25)23(10-11)14-4-6-15(7-5-14)24(27)28/h1-7,9,11H,8,10H2,(H,22,26)/t11-/m0/s1