(3-chlorophenyl)methyl 1-pyrimidin-2-ylpiperidine-2-carboxylate

Systemtic Name: (3-chlorophenyl)methyl 1-pyrimidin-2-ylpiperidine-2-carboxylate Openeye Name: (3-chlorophenyl)methyl 1-pyrimidin-2-ylpiperidine-2-carboxylate CAS Name: 1-(2-pyrimidinyl)-2-piperidinecarboxylic acid (3-chlorophenyl)methyl ester IUPAC Name: (3-chlorophenyl)methyl 1-pyrimidin-2-ylpiperidine-2-carboxylate Traditional Name: 1-(2-pyrimidyl)pipecolinic acid (3-chlorobenzyl) ester Formula: C17H18ClN3O2 MolecularWeight: 331.79672

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OCC2=CC(=CC=C2)Cl)C3=NC=CC=N3

Isomeric SMILES

C1CCN(C(C1)C(=O)OCC2=CC(=CC=C2)Cl)C3=NC=CC=N3

InChI

InChI=1S/C17H18ClN3O2/c18-14-6-3-5-13(11-14)12-23-16(22)15-7-1-2-10-21(15)17-19-8-4-9-20-17/h3-6,8-9,11,15H,1-2,7,10,12H2