N-(6-imidazol-1-ylpyridin-3-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-(6-imidazol-1-ylpyridin-3-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-(6-imidazol-1-yl-3-pyridyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-[6-(1-imidazolyl)-3-pyridinyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-(6-imidazol-1-ylpyridin-3-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-(6-imidazol-1-yl-3-pyridyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C21H19F3N6O3 MolecularWeight: 460.40917

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CN=C(C=C2)N3C=CN=C3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CN=C(C=C2)N3C=CN=C3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C21H19F3N6O3/c22-21(23,24)15-1-3-17(18(11-15)30(32)33)28-8-5-14(6-9-28)20(31)27-16-2-4-19(26-12-16)29-10-7-25-13-29/h1-4,7,10-14H,5-6,8-9H2,(H,27,31)