N-(5-morpholin-4-ylpyridin-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-(5-morpholin-4-ylpyridin-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-(5-morpholino-2-pyridyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-[5-(4-morpholinyl)-2-pyridinyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-(5-morpholin-4-ylpyridin-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-(5-morpholino-2-pyridyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C22H24F3N5O4 MolecularWeight: 479.45227

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC=C(C=C2)N3CCOCC3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC=C(C=C2)N3CCOCC3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C22H24F3N5O4/c23-22(24,25)16-1-3-18(19(13-16)30(32)33)29-7-5-15(6-8-29)21(31)27-20-4-2-17(14-26-20)28-9-11-34-12-10-28/h1-4,13-15H,5-12H2,(H,26,27,31)