tert-butyl 4-[2,2-bis(fluoranyl)-2-pyridin-2-yl-ethanoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2,2-bis(fluoranyl)-2-pyridin-2-yl-ethanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2,2-difluoro-2-(2-pyridyl)acetyl]piperazine-1-carboxylate CAS Name: 4-[2,2-difluoro-1-oxo-2-(2-pyridinyl)ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2,2-difluoro-2-pyridin-2-ylacetyl)piperazine-1-carboxylate Traditional Name: 4-[2,2-difluoro-2-(2-pyridyl)acetyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C16H21F2N3O3 MolecularWeight: 341.353046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C(C2=CC=CC=N2)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C(C2=CC=CC=N2)(F)F

InChI

InChI=1S/C16H21F2N3O3/c1-15(2,3)24-14(23)21-10-8-20(9-11-21)13(22)16(17,18)12-6-4-5-7-19-12/h4-7H,8-11H2,1-3H3