N-[2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-[2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-[2-(2-furyl)-2-pyrrolidin-1-yl-ethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-[2-(2-furanyl)-2-(1-pyrrolidinyl)ethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-[2-(2-furyl)-2-pyrrolidino-ethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C23H27F3N4O4 MolecularWeight: 480.48009

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])C4=CC=CO4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])C4=CC=CO4

InChI

InChI=1S/C23H27F3N4O4/c24-23(25,26)17-5-6-18(19(14-17)30(32)33)29-11-7-16(8-12-29)22(31)27-15-20(21-4-3-13-34-21)28-9-1-2-10-28/h3-6,13-14,16,20H,1-2,7-12,15H2,(H,27,31)