(5S,7R)-N-(4-chloranyl-2-fluoranyl-phenyl)-3-oxidanyl-adamantane-1-carboxamide

Systemtic Name: (5S,7R)-N-(4-chloranyl-2-fluoranyl-phenyl)-3-oxidanyl-adamantane-1-carboxamide Openeye Name: (5S,7R)-N-(4-chloro-2-fluoro-phenyl)-3-hydroxy-adamantane-1-carboxamide CAS Name: (5S,7R)-N-(4-chloro-2-fluorophenyl)-3-hydroxy-1-adamantanecarboxamide IUPAC Name: (5S,7R)-N-(4-chloro-2-fluorophenyl)-3-hydroxyadamantane-1-carboxamide Traditional Name: (5S,7R)-N-(4-chloro-2-fluoro-phenyl)-3-hydroxy-adamantane-1-carboxamide Formula: C17H19ClFNO2 MolecularWeight: 323.789663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)O)C(=O)NC4=C(C=C(C=C4)Cl)F

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)O)C(=O)NC4=C(C=C(C=C4)Cl)F

InChI

InChI=1S/C17H19ClFNO2/c18-12-1-2-14(13(19)4-12)20-15(21)16-5-10-3-11(6-16)8-17(22,7-10)9-16/h1-2,4,10-11,22H,3,5-9H2,(H,20,21)/t10-,11+,16?,17?