1-(1,1-Dimethylethyl) (2S,4S)-4-(4-chlorophenoxy)-1,2-pyrrolidinedicarboxylate

CAS Registry Number®

686766-53-0
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CAS Name

1-(1,1-Dimethylethyl) (2S,4S)-4-(4-chlorophenoxy)-1,2-pyrrolidinedicarboxylate

Molecular Formula

C16H20ClNO5

Molecular Mass

341.79

Cite this Page

1-(1,1-Dimethylethyl) (2S,4S)-4-(4-chlorophenoxy)-1,2-pyrrolidinedicarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=686766-53-0 (retrieved 2024-09-08) (CAS RN: 686766-53-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H20ClNO5/c1-16(2,3)23-15(21)18-9-12(8-13(18)14(19)20)22-11-6-4-10(17)5-7-11/h4-7,12-13H,8-9H2,1-3H3,(H,19,20)/t12-,13-/m0/s1

InChIKey

InChIKey=XQRJMROGXSIXNT-STQMWFEESA-N

SMILES

C(OC(C)(C)C)(=O)N1[C@H](C(O)=O)C[C@H](OC2=CC=C(Cl)C=C2)C1

Canonical SMILES

O=C(OC(C)(C)C)N1CC(OC2=CC=C(Cl)C=C2)CC1C(=O)O

Other Names for this Substance

  • 1,2-Pyrrolidinedicarboxylic acid, 4-(4-chlorophenoxy)-, 1-(1,1-dimethylethyl) ester, (2S,4S)-
  • 1-(1,1-Dimethylethyl) (2S,4S)-4-(4-chlorophenoxy)-1,2-pyrrolidinedicarboxylate