ethyl 1-[5-ethyl-1-(4-methylphenyl)-3-(2-methylpropyl)pyrazol-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[5-ethyl-1-(4-methylphenyl)-3-(2-methylpropyl)pyrazol-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[5-ethyl-3-isobutyl-1-(p-tolyl)pyrazole-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[5-ethyl-1-(4-methylphenyl)-3-(2-methylpropyl)-4-pyrazolyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-ethyl-1-(4-methylphenyl)-3-(2-methylpropyl)pyrazole-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[5-ethyl-3-isobutyl-1-(p-tolyl)pyrazole-4-carbonyl]nipecotic acid ethyl ester Formula: C25H35N3O3 MolecularWeight: 425.5637

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C2=CC=C(C=C2)C)CC(C)C)C(=O)N3CCCC(C3)C(=O)OCC

Isomeric SMILES

CCC1=C(C(=NN1C2=CC=C(C=C2)C)CC(C)C)C(=O)N3CCCC(C3)C(=O)OCC

InChI

InChI=1S/C25H35N3O3/c1-6-22-23(24(29)27-14-8-9-19(16-27)25(30)31-7-2)21(15-17(3)4)26-28(22)20-12-10-18(5)11-13-20/h10-13,17,19H,6-9,14-16H2,1-5H3