tert-butyl 4-[5-phenyl-2-(phenylcarbonyl)-3,4-dihydropyrazol-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[5-phenyl-2-(phenylcarbonyl)-3,4-dihydropyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-(2-benzoyl-5-phenyl-3,4-dihydropyrazol-3-yl)piperidine-1-carboxylate CAS Name: 4-(2-benzoyl-5-phenyl-3,4-dihydropyrazol-3-yl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-benzoyl-5-phenyl-3,4-dihydropyrazol-3-yl)piperidine-1-carboxylate Traditional Name: 4-(2-benzoyl-5-phenyl-2-pyrazolin-3-yl)piperidine-1-carboxylic acid tert-butyl ester Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2CC(=NN2C(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2CC(=NN2C(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H31N3O3/c1-26(2,3)32-25(31)28-16-14-20(15-17-28)23-18-22(19-10-6-4-7-11-19)27-29(23)24(30)21-12-8-5-9-13-21/h4-13,20,23H,14-18H2,1-3H3