1-(7H-purin-6-yl)-N-[4-(trifluoromethyloxy)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(7H-purin-6-yl)-N-[4-(trifluoromethyloxy)phenyl]piperidine-4-carboxamide Openeye Name: 1-(7H-purin-6-yl)-N-[4-(trifluoromethoxy)phenyl]piperidine-4-carboxamide CAS Name: 1-(7H-purin-6-yl)-N-[4-(trifluoromethoxy)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(7H-purin-6-yl)-N-[4-(trifluoromethoxy)phenyl]piperidine-4-carboxamide Traditional Name: 1-(7H-purin-6-yl)-N-[4-(trifluoromethoxy)phenyl]isonipecotamide Formula: C18H17F3N6O2 MolecularWeight: 406.36179

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)OC(F)(F)F)C3=NC=NC4=C3NC=N4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)OC(F)(F)F)C3=NC=NC4=C3NC=N4

InChI

InChI=1S/C18H17F3N6O2/c19-18(20,21)29-13-3-1-12(2-4-13)26-17(28)11-5-7-27(8-6-11)16-14-15(23-9-22-14)24-10-25-16/h1-4,9-11H,5-8H2,(H,26,28)(H,22,23,24,25)