tert-butyl 4-[2-fluoranyl-4-(methylsulfonyloxymethyl)phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-fluoranyl-4-(methylsulfonyloxymethyl)phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-fluoro-4-(methylsulfonyloxymethyl)phenyl]piperazine-1-carboxylate CAS Name: 4-[2-fluoro-4-(methylsulfonyloxymethyl)phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-fluoro-4-(methylsulfonyloxymethyl)phenyl]piperazine-1-carboxylate Traditional Name: 4-[2-fluoro-4-(methylsulfonyloxymethyl)phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C17H25FN2O5S MolecularWeight: 388.454203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25FN2O5S/c1-17(2,3)25-16(21)20-9-7-19(8-10-20)15-6-5-13(11-14(15)18)12-24-26(4,22)23/h5-6,11H,7-10,12H2,1-4H3