(5S,7R)-3-bromanyl-N-[4-(trifluoromethyloxy)phenyl]adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-bromanyl-N-[4-(trifluoromethyloxy)phenyl]adamantane-1-carboxamide Openeye Name: (5S,7R)-3-bromo-N-[4-(trifluoromethoxy)phenyl]adamantane-1-carboxamide CAS Name: (5S,7R)-3-bromo-N-[4-(trifluoromethoxy)phenyl]-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-bromo-N-[4-(trifluoromethoxy)phenyl]adamantane-1-carboxamide Traditional Name: (5S,7R)-3-bromo-N-[4-(trifluoromethoxy)phenyl]adamantane-1-carboxamide Formula: C18H19BrF3NO2 MolecularWeight: 418.24817

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Br)C(=O)NC4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrF3NO2/c19-17-8-11-5-12(9-17)7-16(6-11,10-17)15(24)23-13-1-3-14(4-2-13)25-18(20,21)22/h1-4,11-12H,5-10H2,(H,23,24)/t11-,12+,16?,17?