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

Systemtic Name: N-[3-(2-methylpropoxy)propyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-(3-isobutoxypropyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-[3-(2-methylpropoxy)propyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-[3-(2-methylpropoxy)propyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-(3-isobutoxypropyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C20H28F3N3O4 MolecularWeight: 431.44923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28F3N3O4/c1-14(2)13-30-11-3-8-24-19(27)15-6-9-25(10-7-15)17-5-4-16(20(21,22)23)12-18(17)26(28)29/h4-5,12,14-15H,3,6-11,13H2,1-2H3,(H,24,27)