(2-oxidanylidene-2-piperidin-1-yl-ethyl) 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate

Systemtic Name: (2-oxidanylidene-2-piperidin-1-yl-ethyl) 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate Openeye Name: [2-oxo-2-(1-piperidyl)ethyl] 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate CAS Name: 4-methoxy-1-[3-(trifluoromethyl)phenyl]-3-pyrazolecarboxylic acid [2-oxo-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-2-piperidin-1-ylethyl) 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate Traditional Name: 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid (2-keto-2-piperidino-ethyl) ester Formula: C19H20F3N3O4 MolecularWeight: 411.37501

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)OCC(=O)N2CCCCC2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

COC1=CN(N=C1C(=O)OCC(=O)N2CCCCC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H20F3N3O4/c1-28-15-11-25(14-7-5-6-13(10-14)19(20,21)22)23-17(15)18(27)29-12-16(26)24-8-3-2-4-9-24/h5-7,10-11H,2-4,8-9,12H2,1H3