(4-chlorophenyl)methyl 2-piperidin-1-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate

Systemtic Name: (4-chlorophenyl)methyl 2-piperidin-1-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: (4-chlorophenyl)methyl 2-(1-piperidyl)-4-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 2-(1-piperidinyl)-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid (4-chlorophenyl)methyl ester IUPAC Name: (4-chlorophenyl)methyl 2-piperidin-1-yl-4-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 2-piperidino-4-(trifluoromethyl)pyrimidine-5-carboxylic acid (4-chlorobenzyl) ester Formula: C18H17ClF3N3O2 MolecularWeight: 399.79469

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=C(C(=N2)C(F)(F)F)C(=O)OCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCN(CC1)C2=NC=C(C(=N2)C(F)(F)F)C(=O)OCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H17ClF3N3O2/c19-13-6-4-12(5-7-13)11-27-16(26)14-10-23-17(24-15(14)18(20,21)22)25-8-2-1-3-9-25/h4-7,10H,1-3,8-9,11H2