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

Systemtic Name: 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-(4-phenylbutan-2-yl)piperidine-4-carboxamide Openeye Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(1-methyl-3-phenyl-propyl)piperidine-4-carboxamide CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-phenylbutan-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-(4-phenylbutan-2-yl)piperidine-4-carboxamide Traditional Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(1-methyl-3-phenyl-propyl)isonipecotamide Formula: C22H25ClF3N3O MolecularWeight: 439.90161

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C2CCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C2CCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C22H25ClF3N3O/c1-15(7-8-16-5-3-2-4-6-16)28-21(30)17-9-11-29(12-10-17)20-19(23)13-18(14-27-20)22(24,25)26/h2-6,13-15,17H,7-12H2,1H3,(H,28,30)