tert-butyl 4-[2-(2-bromanyl-4-fluoranyl-phenoxy)ethanoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(2-bromanyl-4-fluoranyl-phenoxy)ethanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-(2-bromo-4-fluoro-phenoxy)acetyl]piperazine-1-carboxylate CAS Name: 4-[2-(2-bromo-4-fluorophenoxy)-1-oxoethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(2-bromo-4-fluorophenoxy)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(2-bromo-4-fluoro-phenoxy)acetyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C17H22BrFN2O4 MolecularWeight: 417.269983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)COC2=C(C=C(C=C2)F)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)COC2=C(C=C(C=C2)F)Br

InChI

InChI=1S/C17H22BrFN2O4/c1-17(2,3)25-16(23)21-8-6-20(7-9-21)15(22)11-24-14-5-4-12(19)10-13(14)18/h4-5,10H,6-9,11H2,1-3H3