ethyl 1-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]carbonyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]carbonyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[5-(4-fluorophenyl)-1H-pyrazole-4-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-(4-fluorophenyl)-1H-pyrazole-4-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[5-(4-fluorophenyl)-1H-pyrazole-4-carbonyl]isonipecotic acid ethyl ester Formula: C18H20FN3O3 MolecularWeight: 345.368103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20FN3O3/c1-2-25-18(24)13-7-9-22(10-8-13)17(23)15-11-20-21-16(15)12-3-5-14(19)6-4-12/h3-6,11,13H,2,7-10H2,1H3,(H,20,21)