ethyl 1-(4-pyrazol-1-ylphenyl)carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-(4-pyrazol-1-ylphenyl)carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-(4-pyrazol-1-ylbenzoyl)piperidine-3-carboxylate CAS Name: 1-[oxo-[4-(1-pyrazolyl)phenyl]methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-pyrazol-1-ylbenzoyl)piperidine-3-carboxylate Traditional Name: 1-(4-pyrazol-1-ylbenzoyl)nipecotic acid ethyl ester Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C18H21N3O3/c1-2-24-18(23)15-5-3-11-20(13-15)17(22)14-6-8-16(9-7-14)21-12-4-10-19-21/h4,6-10,12,15H,2-3,5,11,13H2,1H3