1-(4-fluorophenyl)sulfonyl-N-[(1S,3R)-5-oxidanyl-2-adamantyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-N-[(1S,3R)-5-oxidanyl-2-adamantyl]pyrrolidine-2-carboxamide Openeye Name: 1-(4-fluorophenyl)sulfonyl-N-[(1S,3R)-5-hydroxy-2-adamantyl]pyrrolidine-2-carboxamide CAS Name: 1-(4-fluorophenyl)sulfonyl-N-[(1S,3R)-5-hydroxy-2-adamantyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(4-fluorophenyl)sulfonyl-N-[(1S,3R)-5-hydroxy-2-adamantyl]pyrrolidine-2-carboxamide Traditional Name: 1-(4-fluorophenyl)sulfonyl-N-[(1S,3R)-5-hydroxy-2-adamantyl]pyrrolidine-2-carboxamide Formula: C21H27FN2O4S MolecularWeight: 422.513483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NC3C4CC5CC3CC(C5)(C4)O

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NC3[C@@H]4CC5C[C@H]3CC(C4)(C5)O

InChI

InChI=1S/C21H27FN2O4S/c22-16-3-5-17(6-4-16)29(27,28)24-7-1-2-18(24)20(25)23-19-14-8-13-9-15(19)12-21(26,10-13)11-14/h3-6,13-15,18-19,26H,1-2,7-12H2,(H,23,25)/t13?,14-,15+,18?,19?,21?