(2-chloranyl-6-fluoranyl-phenyl)methyl 1-pyrimidin-2-ylpiperidine-2-carboxylate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 1-pyrimidin-2-ylpiperidine-2-carboxylate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 1-pyrimidin-2-ylpiperidine-2-carboxylate CAS Name: 1-(2-pyrimidinyl)-2-piperidinecarboxylic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 1-pyrimidin-2-ylpiperidine-2-carboxylate Traditional Name: 1-(2-pyrimidyl)pipecolinic acid (2-chloro-6-fluoro-benzyl) ester Formula: C17H17ClFN3O2 MolecularWeight: 349.787183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OCC2=C(C=CC=C2Cl)F)C3=NC=CC=N3

Isomeric SMILES

C1CCN(C(C1)C(=O)OCC2=C(C=CC=C2Cl)F)C3=NC=CC=N3

InChI

InChI=1S/C17H17ClFN3O2/c18-13-5-3-6-14(19)12(13)11-24-16(23)15-7-1-2-10-22(15)17-20-8-4-9-21-17/h3-6,8-9,15H,1-2,7,10-11H2