2-(1-adamantyl)-N-(5-chloranyl-2-phenoxy-phenyl)pyridine-4-carboxamide

Systemtic Name: 2-(1-adamantyl)-N-(5-chloranyl-2-phenoxy-phenyl)pyridine-4-carboxamide Openeye Name: 2-(1-adamantyl)-N-(5-chloro-2-phenoxy-phenyl)pyridine-4-carboxamide CAS Name: 2-(1-adamantyl)-N-(5-chloro-2-phenoxyphenyl)-4-pyridinecarboxamide IUPAC Name: 2-(1-adamantyl)-N-(5-chloro-2-phenoxyphenyl)pyridine-4-carboxamide Traditional Name: 2-(1-adamantyl)-N-(5-chloro-2-phenoxy-phenyl)isonicotinamide Formula: C28H27ClN2O2 MolecularWeight: 458.97918

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NC=CC(=C4)C(=O)NC5=C(C=CC(=C5)Cl)OC6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NC=CC(=C4)C(=O)NC5=C(C=CC(=C5)Cl)OC6=CC=CC=C6

InChI

InChI=1S/C28H27ClN2O2/c29-22-6-7-25(33-23-4-2-1-3-5-23)24(14-22)31-27(32)21-8-9-30-26(13-21)28-15-18-10-19(16-28)12-20(11-18)17-28/h1-9,13-14,18-20H,10-12,15-17H2,(H,31,32)