1-(1,1-Dimethylethyl) (2S,4R)-4-[(4-chlorophenyl)methyl]-1,2-pyrrolidinedicarboxylate

CAS Registry Number®

959576-35-3
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CAS Name

1-(1,1-Dimethylethyl) (2S,4R)-4-[(4-chlorophenyl)methyl]-1,2-pyrrolidinedicarboxylate

Molecular Formula

C17H22ClNO4

Molecular Mass

339.81

Cite this Page

1-(1,1-Dimethylethyl) (2S,4R)-4-[(4-chlorophenyl)methyl]-1,2-pyrrolidinedicarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=959576-35-3 (retrieved 2024-09-13) (CAS RN: 959576-35-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H22ClNO4/c1-17(2,3)23-16(22)19-10-12(9-14(19)15(20)21)8-11-4-6-13(18)7-5-11/h4-7,12,14H,8-10H2,1-3H3,(H,20,21)/t12-,14+/m1/s1

InChIKey

InChIKey=CYTDFJOBCYJCOQ-OCCSQVGLSA-N

SMILES

C(OC(C)(C)C)(=O)N1[C@H](C(O)=O)C[C@@H](CC2=CC=C(Cl)C=C2)C1

Canonical SMILES

O=C(OC(C)(C)C)N1CC(CC2=CC=C(Cl)C=C2)CC1C(=O)O

Other Names for this Substance

  • 1,2-Pyrrolidinedicarboxylic acid, 4-[(4-chlorophenyl)methyl]-, 1-(1,1-dimethylethyl) ester, (2S,4R)-
  • 1-(1,1-Dimethylethyl) (2S,4R)-4-[(4-chlorophenyl)methyl]-1,2-pyrrolidinedicarboxylate
  • (2S,4R)-1-(tert-Butoxycarbonyl)-4-(4-chlorobenzyl)pyrrolidine-2-carboxylic acid