[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl] 1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxylate

Systemtic Name: [2-(1H-indol-3-yl)-2-oxidanylidene-ethyl] 1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxylate Openeye Name: [2-(1H-indol-3-yl)-2-oxo-ethyl] 1-[5-(trifluoromethyl)-2-pyridyl]piperidine-4-carboxylate CAS Name: 1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinecarboxylic acid [2-(1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(1H-indol-3-yl)-2-oxoethyl] 1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxylate Traditional Name: 1-[5-(trifluoromethyl)-2-pyridyl]isonipecotic acid [2-(1H-indol-3-yl)-2-keto-ethyl] ester Formula: C22H20F3N3O3 MolecularWeight: 431.40771

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC(=O)C2=CNC3=CC=CC=C32)C4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)OCC(=O)C2=CNC3=CC=CC=C32)C4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C22H20F3N3O3/c23-22(24,25)15-5-6-20(27-11-15)28-9-7-14(8-10-28)21(30)31-13-19(29)17-12-26-18-4-2-1-3-16(17)18/h1-6,11-12,14,26H,7-10,13H2