1-(1,1-Dimethylethyl) (2S,4R)-4-[(3-chlorophenyl)methyl]-1,2-pyrrolidinedicarboxylate

CAS Registry Number®

959576-36-4
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CAS Name

1-(1,1-Dimethylethyl) (2S,4R)-4-[(3-chlorophenyl)methyl]-1,2-pyrrolidinedicarboxylate

Molecular Formula

C17H22ClNO4

Molecular Mass

339.81

Cite this Page

1-(1,1-Dimethylethyl) (2S,4R)-4-[(3-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=959576-36-4 (retrieved 2024-05-20) (CAS RN: 959576-36-4).  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)7-11-5-4-6-13(18)8-11/h4-6,8,12,14H,7,9-10H2,1-3H3,(H,20,21)/t12-,14+/m1/s1

InChIKey

InChIKey=RAJKVFMPBMVDDC-OCCSQVGLSA-N

SMILES

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

Canonical SMILES

O=C(OC(C)(C)C)N1CC(CC=2C=CC=C(Cl)C2)CC1C(=O)O

Other Names for this Substance

  • 1,2-Pyrrolidinedicarboxylic acid, 4-[(3-chlorophenyl)methyl]-, 1-(1,1-dimethylethyl) ester, (2S,4R)-
  • 1-(1,1-Dimethylethyl) (2S,4R)-4-[(3-chlorophenyl)methyl]-1,2-pyrrolidinedicarboxylate
  • (2S,4R)-1-(tert-Butoxycarbonyl)-4-(3-chlorobenzyl)pyrrolidine-2-carboxylic acid

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