tert-butyl 4-[2-ethyl-5-[[4-[(2-methylpropan-2-yl)oxy]phenyl]methyl]pyrazol-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-ethyl-5-[[4-[(2-methylpropan-2-yl)oxy]phenyl]methyl]pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[5-[(4-tert-butoxyphenyl)methyl]-2-ethyl-pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[2-ethyl-5-[[4-[(2-methylpropan-2-yl)oxy]phenyl]methyl]-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-ethyl-5-[[4-[(2-methylpropan-2-yl)oxy]phenyl]methyl]pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[5-(4-tert-butoxybenzyl)-2-ethyl-pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H39N3O3 MolecularWeight: 441.60616

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)CC2=CC=C(C=C2)OC(C)(C)C)C3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CCN1C(=CC(=N1)CC2=CC=C(C=C2)OC(C)(C)C)C3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H39N3O3/c1-8-29-23(20-13-15-28(16-14-20)24(30)32-26(5,6)7)18-21(27-29)17-19-9-11-22(12-10-19)31-25(2,3)4/h9-12,18,20H,8,13-17H2,1-7H3