1-(1,1-Dimethylethyl) (2S,4S)-4-[2-chloro-4-(1,1-dimethylpropyl)phenoxy]-1,2-pyrrolidinedicarboxylate

CAS Registry Number®

1354485-82-7
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CAS Name

1-(1,1-Dimethylethyl) (2S,4S)-4-[2-chloro-4-(1,1-dimethylpropyl)phenoxy]-1,2-pyrrolidinedicarboxylate

Molecular Formula

C21H30ClNO5

Molecular Mass

411.92

Cite this Page

1-(1,1-Dimethylethyl) (2S,4S)-4-[2-chloro-4-(1,1-dimethylpropyl)phenoxy]-1,2-pyrrolidinedicarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1354485-82-7 (retrieved 2024-08-14) (CAS RN: 1354485-82-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H30ClNO5/c1-7-21(5,6)13-8-9-17(15(22)10-13)27-14-11-16(18(24)25)23(12-14)19(26)28-20(2,3)4/h8-10,14,16H,7,11-12H2,1-6H3,(H,24,25)/t14-,16-/m0/s1

InChIKey

InChIKey=GTPIAVOUBNDUMQ-HOCLYGCPSA-N

SMILES

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

Canonical SMILES

O=C(OC(C)(C)C)N1CC(OC2=CC=C(C=C2Cl)C(C)(C)CC)CC1C(=O)O

Other Names for this Substance

  • 1,2-Pyrrolidinedicarboxylic acid, 4-[2-chloro-4-(1,1-dimethylpropyl)phenoxy]-, 1-(1,1-dimethylethyl) ester, (2S,4S)-
  • 1-(1,1-Dimethylethyl) (2S,4S)-4-[2-chloro-4-(1,1-dimethylpropyl)phenoxy]-1,2-pyrrolidinedicarboxylate