ethyl 1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(3,5-dimethyl-1-phenyl-pyrazole-4-carbonyl)piperidine-4-carboxylate CAS Name: 1-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3,5-dimethyl-1-phenylpyrazole-4-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(3,5-dimethyl-1-phenyl-pyrazole-4-carbonyl)isonipecotic acid ethyl ester Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C20H25N3O3/c1-4-26-20(25)16-10-12-22(13-11-16)19(24)18-14(2)21-23(15(18)3)17-8-6-5-7-9-17/h5-9,16H,4,10-13H2,1-3H3