N-[1-(2-fluoranyl-4-pyridin-4-yl-phenyl)piperidin-3-yl]-4-oxidanyl-adamantane-1-carboxamide

Systemtic Name: N-[1-(2-fluoranyl-4-pyridin-4-yl-phenyl)piperidin-3-yl]-4-oxidanyl-adamantane-1-carboxamide Openeye Name: N-[1-[2-fluoro-4-(4-pyridyl)phenyl]-3-piperidyl]-4-hydroxy-adamantane-1-carboxamide CAS Name: N-[1-(2-fluoro-4-pyridin-4-ylphenyl)-3-piperidinyl]-4-hydroxy-1-adamantanecarboxamide IUPAC Name: N-[1-(2-fluoro-4-pyridin-4-ylphenyl)piperidin-3-yl]-4-hydroxyadamantane-1-carboxamide Traditional Name: N-[1-[2-fluoro-4-(4-pyridyl)phenyl]-3-piperidyl]-4-hydroxy-adamantane-1-carboxamide Formula: C27H32FN3O2 MolecularWeight: 449.560283

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=C(C=C2)C3=CC=NC=C3)F)NC(=O)C45CC6CC(C4)C(C(C6)C5)O

Isomeric SMILES

C1CC(CN(C1)C2=C(C=C(C=C2)C3=CC=NC=C3)F)NC(=O)C45CC6CC(C4)C(C(C6)C5)O

InChI

InChI=1S/C27H32FN3O2/c28-23-12-19(18-5-7-29-8-6-18)3-4-24(23)31-9-1-2-22(16-31)30-26(33)27-13-17-10-20(14-27)25(32)21(11-17)15-27/h3-8,12,17,20-22,25,32H,1-2,9-11,13-16H2,(H,30,33)