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

Systemtic Name: N-(3-aminocarbonyl-4-chloranyl-phenyl)-1-[3-(trifluoromethyl)pyridin-2-yl]piperidine-3-carboxamide Openeye Name: N-(3-carbamoyl-4-chloro-phenyl)-1-[3-(trifluoromethyl)-2-pyridyl]piperidine-3-carboxamide CAS Name: N-(3-carbamoyl-4-chlorophenyl)-1-[3-(trifluoromethyl)-2-pyridinyl]-3-piperidinecarboxamide IUPAC Name: N-(3-carbamoyl-4-chlorophenyl)-1-[3-(trifluoromethyl)pyridin-2-yl]piperidine-3-carboxamide Traditional Name: N-(3-carbamoyl-4-chloro-phenyl)-1-[3-(trifluoromethyl)-2-pyridyl]nipecotamide Formula: C19H18ClF3N4O2 MolecularWeight: 426.82003

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=CC=N2)C(F)(F)F)C(=O)NC3=CC(=C(C=C3)Cl)C(=O)N

Isomeric SMILES

C1CC(CN(C1)C2=C(C=CC=N2)C(F)(F)F)C(=O)NC3=CC(=C(C=C3)Cl)C(=O)N

InChI

InChI=1S/C19H18ClF3N4O2/c20-15-6-5-12(9-13(15)16(24)28)26-18(29)11-3-2-8-27(10-11)17-14(19(21,22)23)4-1-7-25-17/h1,4-7,9,11H,2-3,8,10H2,(H2,24,28)(H,26,29)