ethyl 1-[1-(4-methylphenyl)-5-(trifluoromethyl)pyrazol-4-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[1-(4-methylphenyl)-5-(trifluoromethyl)pyrazol-4-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[1-(p-tolyl)-5-(trifluoromethyl)pyrazole-4-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[1-(4-methylphenyl)-5-(trifluoromethyl)-4-pyrazolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(4-methylphenyl)-5-(trifluoromethyl)pyrazole-4-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[1-(p-tolyl)-5-(trifluoromethyl)pyrazole-4-carbonyl]isonipecotic acid ethyl ester Formula: C20H22F3N3O3 MolecularWeight: 409.40219

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=C(N(N=C2)C3=CC=C(C=C3)C)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=C(N(N=C2)C3=CC=C(C=C3)C)C(F)(F)F

InChI

InChI=1S/C20H22F3N3O3/c1-3-29-19(28)14-8-10-25(11-9-14)18(27)16-12-24-26(17(16)20(21,22)23)15-6-4-13(2)5-7-15/h4-7,12,14H,3,8-11H2,1-2H3