(4-pyrazol-1-ylphenyl)methyl 1-pyrimidin-2-ylpiperidine-2-carboxylate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 1-pyrimidin-2-ylpiperidine-2-carboxylate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 1-pyrimidin-2-ylpiperidine-2-carboxylate CAS Name: 1-(2-pyrimidinyl)-2-piperidinecarboxylic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 1-pyrimidin-2-ylpiperidine-2-carboxylate Traditional Name: 1-(2-pyrimidyl)pipecolinic acid (4-pyrazol-1-ylbenzyl) ester Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3)C4=NC=CC=N4

Isomeric SMILES

C1CCN(C(C1)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3)C4=NC=CC=N4

InChI

InChI=1S/C20H21N5O2/c26-19(18-5-1-2-13-24(18)20-21-10-3-11-22-20)27-15-16-6-8-17(9-7-16)25-14-4-12-23-25/h3-4,6-12,14,18H,1-2,5,13,15H2