N-(5-chloranylpyridin-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-(5-chloro-2-pyridyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-(5-chloro-2-pyridinyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-(5-chloropyridin-2-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-(5-chloro-2-pyridyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C18H16ClF3N4O3 MolecularWeight: 428.79285

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC=C(C=C2)Cl)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC=C(C=C2)Cl)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H16ClF3N4O3/c19-13-2-4-16(23-10-13)24-17(27)11-5-7-25(8-6-11)14-3-1-12(18(20,21)22)9-15(14)26(28)29/h1-4,9-11H,5-8H2,(H,23,24,27)