N-[2-oxidanylidene-2-[[4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]methylamino]ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-oxidanylidene-2-[[4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]methylamino]ethyl]adamantane-1-carboxamide Openeye Name: N-[2-oxo-2-[[4-(2,2,2-trifluoroethoxy)phenyl]methylamino]ethyl]adamantane-1-carboxamide CAS Name: N-[2-oxo-2-[[4-(2,2,2-trifluoroethoxy)phenyl]methylamino]ethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-oxo-2-[[4-(2,2,2-trifluoroethoxy)phenyl]methylamino]ethyl]adamantane-1-carboxamide Traditional Name: N-[2-keto-2-[[4-(2,2,2-trifluoroethoxy)benzyl]amino]ethyl]adamantane-1-carboxamide Formula: C22H27F3N2O3 MolecularWeight: 424.45659

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)NCC4=CC=C(C=C4)OCC(F)(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)NCC4=CC=C(C=C4)OCC(F)(F)F

InChI

InChI=1S/C22H27F3N2O3/c23-22(24,25)13-30-18-3-1-14(2-4-18)11-26-19(28)12-27-20(29)21-8-15-5-16(9-21)7-17(6-15)10-21/h1-4,15-17H,5-13H2,(H,26,28)(H,27,29)