ethyl 1-[1-(3-chlorophenyl)-5-ethyl-pyrazol-4-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[1-(3-chlorophenyl)-5-ethyl-pyrazol-4-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[1-(3-chlorophenyl)-5-ethyl-pyrazole-4-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[1-(3-chlorophenyl)-5-ethyl-4-pyrazolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(3-chlorophenyl)-5-ethylpyrazole-4-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[1-(3-chlorophenyl)-5-ethyl-pyrazole-4-carbonyl]isonipecotic acid ethyl ester Formula: C20H24ClN3O3 MolecularWeight: 389.87586

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)N3CCC(CC3)C(=O)OCC

Isomeric SMILES

CCC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)N3CCC(CC3)C(=O)OCC

InChI

InChI=1S/C20H24ClN3O3/c1-3-18-17(13-22-24(18)16-7-5-6-15(21)12-16)19(25)23-10-8-14(9-11-23)20(26)27-4-2/h5-7,12-14H,3-4,8-11H2,1-2H3