N-(3-chloranyl-2-fluoranyl-phenyl)-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-2-fluoranyl-phenyl)-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide Openeye Name: N-(3-chloro-2-fluoro-phenyl)-1-[5-(trifluoromethyl)-2-pyridyl]piperidine-4-carboxamide CAS Name: N-(3-chloro-2-fluorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-2-fluorophenyl)-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide Traditional Name: N-(3-chloro-2-fluoro-phenyl)-1-[5-(trifluoromethyl)-2-pyridyl]isonipecotamide Formula: C18H16ClF4N3O MolecularWeight: 401.785753

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(C(=CC=C2)Cl)F)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(C(=CC=C2)Cl)F)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H16ClF4N3O/c19-13-2-1-3-14(16(13)20)25-17(27)11-6-8-26(9-7-11)15-5-4-12(10-24-15)18(21,22)23/h1-5,10-11H,6-9H2,(H,25,27)