2-[1-(2-fluoranyl-4-nitro-phenyl)carbonylpiperidin-4-yl]-N-(3-imidazol-1-ylpropyl)-6-methyl-pyridine-3-carboxamide

Systemtic Name: 2-[1-(2-fluoranyl-4-nitro-phenyl)carbonylpiperidin-4-yl]-N-(3-imidazol-1-ylpropyl)-6-methyl-pyridine-3-carboxamide Openeye Name: 2-[1-(2-fluoro-4-nitro-benzoyl)-4-piperidyl]-N-(3-imidazol-1-ylpropyl)-6-methyl-pyridine-3-carboxamide CAS Name: 2-[1-[(2-fluoro-4-nitrophenyl)-oxomethyl]-4-piperidinyl]-N-[3-(1-imidazolyl)propyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: 2-[1-(2-fluoro-4-nitrobenzoyl)piperidin-4-yl]-N-(3-imidazol-1-ylpropyl)-6-methylpyridine-3-carboxamide Traditional Name: 2-[1-(2-fluoro-4-nitro-benzoyl)-4-piperidyl]-N-(3-imidazol-1-ylpropyl)-6-methyl-nicotinamide Formula: C25H27FN6O4 MolecularWeight: 494.518083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCCCN2C=CN=C2)C3CCN(CC3)C(=O)C4=C(C=C(C=C4)[N+](=O)[O-])F

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCCCN2C=CN=C2)C3CCN(CC3)C(=O)C4=C(C=C(C=C4)[N+](=O)[O-])F

InChI

InChI=1S/C25H27FN6O4/c1-17-3-5-21(24(33)28-9-2-11-30-14-10-27-16-30)23(29-17)18-7-12-31(13-8-18)25(34)20-6-4-19(32(35)36)15-22(20)26/h3-6,10,14-16,18H,2,7-9,11-13H2,1H3,(H,28,33)