ethyl 1-(4-pyrazol-1-ylphenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(4-pyrazol-1-ylphenyl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(4-pyrazol-1-ylbenzoyl)piperidine-4-carboxylate CAS Name: 1-[oxo-[4-(1-pyrazolyl)phenyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-pyrazol-1-ylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-pyrazol-1-ylbenzoyl)isonipecotic acid ethyl ester Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C18H21N3O3/c1-2-24-18(23)15-8-12-20(13-9-15)17(22)14-4-6-16(7-5-14)21-11-3-10-19-21/h3-7,10-11,15H,2,8-9,12-13H2,1H3