rel-1-(1,1-Dimethylethyl) (3R,4S)-4-[3-(methoxymethyl)phenyl]-1,3-pyrrolidinedicarboxylate

CAS Registry Number®

1161787-85-4
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CAS Name

rel-1-(1,1-Dimethylethyl) (3R,4S)-4-[3-(methoxymethyl)phenyl]-1,3-pyrrolidinedicarboxylate

Molecular Formula

C18H25NO5

Molecular Mass

335.39

Cite this Page

rel-1-(1,1-Dimethylethyl) (3R,4S)-4-[3-(methoxymethyl)phenyl]-1,3-pyrrolidinedicarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1161787-85-4 (retrieved 2024-08-21) (CAS RN: 1161787-85-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C18H25NO5/c1-18(2,3)24-17(22)19-9-14(15(10-19)16(20)21)13-7-5-6-12(8-13)11-23-4/h5-8,14-15H,9-11H2,1-4H3,(H,20,21)/t14-,15+/s2

InChIKey

InChIKey=WBUKCTAOALJTAN-PVRQQBJHNA-N

SMILES

C(O)(=O)[C@H]1[C@@H](CN(C(OC(C)(C)C)=O)C1)C2=CC(COC)=CC=C2

Canonical SMILES

O=C(OC(C)(C)C)N1CC(C(=O)O)C(C=2C=CC=C(C2)COC)C1

Other Names for this Substance

  • 1,3-Pyrrolidinedicarboxylic acid, 4-[3-(methoxymethyl)phenyl]-, 1-(1,1-dimethylethyl) ester, (3R,4S)-rel-
  • rel-1-(1,1-Dimethylethyl) (3R,4S)-4-[3-(methoxymethyl)phenyl]-1,3-pyrrolidinedicarboxylate