1,1-Dimethylethyl 4-[[(2-chloro-6-fluorophenyl)methyl]sulfonyl]-1-piperazinecarboxylate

CAS Registry Number®

1420955-75-4

CAS Name

1,1-Dimethylethyl 4-[[(2-chloro-6-fluorophenyl)methyl]sulfonyl]-1-piperazinecarboxylate

Molecular Formula

C16H22ClFN2O4S

Molecular Mass

392.87

Cite this Page

1,1-Dimethylethyl 4-[[(2-chloro-6-fluorophenyl)methyl]sulfonyl]-1-piperazinecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1420955-75-4 (retrieved 2024-12-12) (CAS RN: 1420955-75-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H22ClFN2O4S/c1-16(2,3)24-15(21)19-7-9-20(10-8-19)25(22,23)11-12-13(17)5-4-6-14(12)18/h4-6H,7-11H2,1-3H3

InChIKey

InChIKey=ZXINAGYDBMUHRB-UHFFFAOYSA-N

SMILES

S(CC1=C(Cl)C=CC=C1F)(=O)(=O)N2CCN(C(OC(C)(C)C)=O)CC2

Canonical SMILES

O=C(OC(C)(C)C)N1CCN(CC1)S(=O)(=O)CC=2C(F)=CC=CC2Cl

Other Names for this Substance

  • 1-Piperazinecarboxylic acid, 4-[[(2-chloro-6-fluorophenyl)methyl]sulfonyl]-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 4-[[(2-chloro-6-fluorophenyl)methyl]sulfonyl]-1-piperazinecarboxylate

CAS INSIGHTSTM
Abstract molecules design, Atoms, Medical background