N-(4,5-dimethoxy-2-methyl-phenyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-(4,5-dimethoxy-2-methyl-phenyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-(4,5-dimethoxy-2-methyl-phenyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-(4,5-dimethoxy-2-methylphenyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-(4,5-dimethoxy-2-methylphenyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-(4,5-dimethoxy-2-methyl-phenyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C22H24F3N3O5 MolecularWeight: 467.43827

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C22H24F3N3O5/c1-13-10-19(32-2)20(33-3)12-16(13)26-21(29)14-6-8-27(9-7-14)17-5-4-15(22(23,24)25)11-18(17)28(30)31/h4-5,10-12,14H,6-9H2,1-3H3,(H,26,29)