N-(2-ethyl-6-methyl-phenyl)-1-[3-(trifluoromethyl)pyridin-2-yl]piperidine-3-carboxamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-1-[3-(trifluoromethyl)pyridin-2-yl]piperidine-3-carboxamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-1-[3-(trifluoromethyl)-2-pyridyl]piperidine-3-carboxamide CAS Name: N-(2-ethyl-6-methylphenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]-3-piperidinecarboxamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-1-[3-(trifluoromethyl)pyridin-2-yl]piperidine-3-carboxamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-1-[3-(trifluoromethyl)-2-pyridyl]nipecotamide Formula: C21H24F3N3O MolecularWeight: 391.42997

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2CCCN(C2)C3=C(C=CC=N3)C(F)(F)F)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2CCCN(C2)C3=C(C=CC=N3)C(F)(F)F)C

InChI

InChI=1S/C21H24F3N3O/c1-3-15-8-4-7-14(2)18(15)26-20(28)16-9-6-12-27(13-16)19-17(21(22,23)24)10-5-11-25-19/h4-5,7-8,10-11,16H,3,6,9,12-13H2,1-2H3,(H,26,28)