(phenylmethyl) 4-[[[3-(trifluoromethyl)pyridin-2-yl]amino]methyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[[[3-(trifluoromethyl)pyridin-2-yl]amino]methyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[[[3-(trifluoromethyl)-2-pyridyl]amino]methyl]piperidine-1-carboxylate CAS Name: 4-[[[3-(trifluoromethyl)-2-pyridinyl]amino]methyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[[3-(trifluoromethyl)pyridin-2-yl]amino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[[3-(trifluoromethyl)-2-pyridyl]amino]methyl]piperidine-1-carboxylic acid benzyl ester Formula: C20H22F3N3O2 MolecularWeight: 393.40279

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC2=C(C=CC=N2)C(F)(F)F)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1CNC2=C(C=CC=N2)C(F)(F)F)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H22F3N3O2/c21-20(22,23)17-7-4-10-24-18(17)25-13-15-8-11-26(12-9-15)19(27)28-14-16-5-2-1-3-6-16/h1-7,10,15H,8-9,11-14H2,(H,24,25)