1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]piperidine-4-carboxamide Openeye Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]piperidine-4-carboxamide CAS Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]piperidine-4-carboxamide Traditional Name: N-[3-(2-ketopyrrolidino)propyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C20H25F3N4O4 MolecularWeight: 442.43211

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCNC(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1)CCCNC(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H25F3N4O4/c21-20(22,23)15-4-5-16(17(13-15)27(30)31)25-11-6-14(7-12-25)19(29)24-8-2-10-26-9-1-3-18(26)28/h4-5,13-14H,1-3,6-12H2,(H,24,29)