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

CAS Registry Number®

869681-95-8
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CAS Name

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

Molecular Formula

C17H23NO5

Molecular Mass

321.37

Cite this Page

1-(1,1-Dimethylethyl) (2S,4S)-4-(2-methylphenoxy)-1,2-pyrrolidinedicarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=869681-95-8 (retrieved 2024-08-18) (CAS RN: 869681-95-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H23NO5/c1-11-7-5-6-8-14(11)22-12-9-13(15(19)20)18(10-12)16(21)23-17(2,3)4/h5-8,12-13H,9-10H2,1-4H3,(H,19,20)/t12-,13-/m0/s1

InChIKey

InChIKey=NNYBPYGAJNJRLN-STQMWFEESA-N

SMILES

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

Canonical SMILES

O=C(OC(C)(C)C)N1CC(OC=2C=CC=CC2C)CC1C(=O)O

Other Names for this Substance

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