N-[(2R)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-[(2R)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-[(2R)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-[(2R)-4-methyl-2-(4-morpholin-4-iumyl)pentyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-[(2R)-4-methyl-2-morpholin-4-ium-4-ylpentyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-[(2R)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C23H34F3N4O4+ MolecularWeight: 487.53567

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNC(=O)C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])[NH+]3CCOCC3

Isomeric SMILES

CC(C)C[C@H](CNC(=O)C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])[NH+]3CCOCC3

InChI

InChI=1S/C23H33F3N4O4/c1-16(2)13-19(28-9-11-34-12-10-28)15-27-22(31)17-5-7-29(8-6-17)20-4-3-18(23(24,25)26)14-21(20)30(32)33/h3-4,14,16-17,19H,5-13,15H2,1-2H3,(H,27,31)/p+1/t19-/m1/s1