1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[phenyl(pyridin-2-yl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[phenyl(pyridin-2-yl)methyl]piperidine-4-carboxamide Openeye Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[phenyl(2-pyridyl)methyl]piperidine-4-carboxamide CAS Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[phenyl(2-pyridinyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[phenyl(pyridin-2-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[phenyl(2-pyridyl)methyl]isonipecotamide Formula: C25H23F3N4O3 MolecularWeight: 484.47033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC(C2=CC=CC=C2)C3=CC=CC=N3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NC(C2=CC=CC=C2)C3=CC=CC=N3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C25H23F3N4O3/c26-25(27,28)19-9-10-21(22(16-19)32(34)35)31-14-11-18(12-15-31)24(33)30-23(17-6-2-1-3-7-17)20-8-4-5-13-29-20/h1-10,13,16,18,23H,11-12,14-15H2,(H,30,33)