ethyl 5-[[4-oxidanyl-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]methyl]-1-pyridin-2-yl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[[4-oxidanyl-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]methyl]-1-pyridin-2-yl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[4-hydroxy-4-[3-(trifluoromethyl)phenyl]-1-piperidyl]methyl]-1-(2-pyridyl)pyrazole-4-carboxylate CAS Name: 5-[[4-hydroxy-4-[3-(trifluoromethyl)phenyl]-1-piperidinyl]methyl]-1-(2-pyridinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]methyl]-1-pyridin-2-ylpyrazole-4-carboxylate Traditional Name: 5-[[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidino]methyl]-1-(2-pyridyl)pyrazole-4-carboxylic acid ethyl ester Formula: C24H25F3N4O3 MolecularWeight: 474.47551

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=N2)CN3CCC(CC3)(C4=CC(=CC=C4)C(F)(F)F)O

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=N2)CN3CCC(CC3)(C4=CC(=CC=C4)C(F)(F)F)O

InChI

InChI=1S/C24H25F3N4O3/c1-2-34-22(32)19-15-29-31(21-8-3-4-11-28-21)20(19)16-30-12-9-23(33,10-13-30)17-6-5-7-18(14-17)24(25,26)27/h3-8,11,14-15,33H,2,9-10,12-13,16H2,1H3