ethyl 4-[4-ethoxy-1-(4-fluorophenyl)pyrazol-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-ethoxy-1-(4-fluorophenyl)pyrazol-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-ethoxy-1-(4-fluorophenyl)pyrazole-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[4-ethoxy-1-(4-fluorophenyl)-3-pyrazolyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-ethoxy-1-(4-fluorophenyl)pyrazole-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[4-ethoxy-1-(4-fluorophenyl)pyrazole-3-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H23FN4O4 MolecularWeight: 390.408723

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CN(N=C1C(=O)N2CCN(CC2)C(=O)OCC)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CN(N=C1C(=O)N2CCN(CC2)C(=O)OCC)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H23FN4O4/c1-3-27-16-13-24(15-7-5-14(20)6-8-15)21-17(16)18(25)22-9-11-23(12-10-22)19(26)28-4-2/h5-8,13H,3-4,9-12H2,1-2H3