N-(1H-benzimidazol-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-(1H-benzimidazol-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-(1H-benzimidazol-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-(1H-benzimidazol-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-(1H-benzimidazol-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-(1H-benzimidazol-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C20H18F3N5O3 MolecularWeight: 433.38383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC3=CC=CC=C3N2)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC3=CC=CC=C3N2)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H18F3N5O3/c21-20(22,23)13-5-6-16(17(11-13)28(30)31)27-9-7-12(8-10-27)18(29)26-19-24-14-3-1-2-4-15(14)25-19/h1-6,11-12H,7-10H2,(H2,24,25,26,29)