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

Systemtic Name: (3S)-1-(4-butylphenyl)-5-oxidanylidene-N-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide Openeye Name: (3S)-1-(4-butylphenyl)-5-oxo-N-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide CAS Name: (3S)-1-(4-butylphenyl)-5-oxo-N-[3-(trifluoromethyl)phenyl]-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-(4-butylphenyl)-5-oxo-N-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide Traditional Name: (3S)-1-(4-butylphenyl)-5-keto-N-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide Formula: C22H23F3N2O2 MolecularWeight: 404.42543

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C22H23F3N2O2/c1-2-3-5-15-8-10-19(11-9-15)27-14-16(12-20(27)28)21(29)26-18-7-4-6-17(13-18)22(23,24)25/h4,6-11,13,16H,2-3,5,12,14H2,1H3,(H,26,29)/t16-/m0/s1