N-(3-methoxypropyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-(3-methoxypropyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-(3-methoxypropyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-(3-methoxypropyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-(3-methoxypropyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-(3-methoxypropyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C17H22F3N3O4 MolecularWeight: 389.36949

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COCCCNC(=O)C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C17H22F3N3O4/c1-27-10-2-7-21-16(24)12-5-8-22(9-6-12)14-4-3-13(17(18,19)20)11-15(14)23(25)26/h3-4,11-12H,2,5-10H2,1H3,(H,21,24)