ethyl 5-tert-butyl-1-(1-quinolin-3-ylcarbonylpiperidin-4-yl)pyrazole-3-carboxylate

Systemtic Name: ethyl 5-tert-butyl-1-(1-quinolin-3-ylcarbonylpiperidin-4-yl)pyrazole-3-carboxylate Openeye Name: ethyl 5-tert-butyl-1-[1-(quinoline-3-carbonyl)-4-piperidyl]pyrazole-3-carboxylate CAS Name: 5-tert-butyl-1-[1-[oxo(3-quinolinyl)methyl]-4-piperidinyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-tert-butyl-1-[1-(quinoline-3-carbonyl)piperidin-4-yl]pyrazole-3-carboxylate Traditional Name: 5-tert-butyl-1-[1-(quinoline-3-carbonyl)-4-piperidyl]pyrazole-3-carboxylic acid ethyl ester Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C(C)(C)C)C2CCN(CC2)C(=O)C3=CC4=CC=CC=C4N=C3

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C(C)(C)C)C2CCN(CC2)C(=O)C3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C25H30N4O3/c1-5-32-24(31)21-15-22(25(2,3)4)29(27-21)19-10-12-28(13-11-19)23(30)18-14-17-8-6-7-9-20(17)26-16-18/h6-9,14-16,19H,5,10-13H2,1-4H3