2-(1-adamantyl)-N-[2-chloranyl-5-(trifluoromethyl)phenyl]pyridine-4-carboxamide

Systemtic Name: 2-(1-adamantyl)-N-[2-chloranyl-5-(trifluoromethyl)phenyl]pyridine-4-carboxamide Openeye Name: 2-(1-adamantyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]pyridine-4-carboxamide CAS Name: 2-(1-adamantyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]-4-pyridinecarboxamide IUPAC Name: 2-(1-adamantyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]pyridine-4-carboxamide Traditional Name: 2-(1-adamantyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]isonicotinamide Formula: C23H22ClF3N2O MolecularWeight: 434.88179

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NC=CC(=C4)C(=O)NC5=C(C=CC(=C5)C(F)(F)F)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NC=CC(=C4)C(=O)NC5=C(C=CC(=C5)C(F)(F)F)Cl

InChI

InChI=1S/C23H22ClF3N2O/c24-18-2-1-17(23(25,26)27)9-19(18)29-21(30)16-3-4-28-20(8-16)22-10-13-5-14(11-22)7-15(6-13)12-22/h1-4,8-9,13-15H,5-7,10-12H2,(H,29,30)