tert-butyl (2R)-2-methyl-4-[3-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl (2R)-2-methyl-4-[3-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxylate Openeye Name: tert-butyl (2R)-2-methyl-4-[3-(trifluoromethyl)-2-pyridyl]piperazine-1-carboxylate CAS Name: (2R)-2-methyl-4-[3-(trifluoromethyl)-2-pyridinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-methyl-4-[3-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxylate Traditional Name: (2R)-2-methyl-4-[3-(trifluoromethyl)-2-pyridyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C16H22F3N3O2 MolecularWeight: 345.35999

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)OC(C)(C)C)C2=C(C=CC=N2)C(F)(F)F

Isomeric SMILES

C[C@@H]1CN(CCN1C(=O)OC(C)(C)C)C2=C(C=CC=N2)C(F)(F)F

InChI

InChI=1S/C16H22F3N3O2/c1-11-10-21(8-9-22(11)14(23)24-15(2,3)4)13-12(16(17,18)19)6-5-7-20-13/h5-7,11H,8-10H2,1-4H3/t11-/m1/s1