1-(3-pyrrol-1-ylpyridin-2-yl)-N-[4-(trifluoromethyloxy)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(3-pyrrol-1-ylpyridin-2-yl)-N-[4-(trifluoromethyloxy)phenyl]piperidine-4-carboxamide Openeye Name: 1-(3-pyrrol-1-yl-2-pyridyl)-N-[4-(trifluoromethoxy)phenyl]piperidine-4-carboxamide CAS Name: 1-[3-(1-pyrrolyl)-2-pyridinyl]-N-[4-(trifluoromethoxy)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(3-pyrrol-1-ylpyridin-2-yl)-N-[4-(trifluoromethoxy)phenyl]piperidine-4-carboxamide Traditional Name: 1-(3-pyrrol-1-yl-2-pyridyl)-N-[4-(trifluoromethoxy)phenyl]isonipecotamide Formula: C22H21F3N4O2 MolecularWeight: 430.42295

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)OC(F)(F)F)C3=C(C=CC=N3)N4C=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)OC(F)(F)F)C3=C(C=CC=N3)N4C=CC=C4

InChI

InChI=1S/C22H21F3N4O2/c23-22(24,25)31-18-7-5-17(6-8-18)27-21(30)16-9-14-29(15-10-16)20-19(4-3-11-26-20)28-12-1-2-13-28/h1-8,11-13,16H,9-10,14-15H2,(H,27,30)