rel-1-(1,1-Dimethylethyl) 3-methyl (3R,4R)-4-(4-chloro-3-pyridinyl)-1,3-pyrrolidinedicarboxylate

CAS Registry Number®

1228666-10-1
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CAS Name

rel-1-(1,1-Dimethylethyl) 3-methyl (3R,4R)-4-(4-chloro-3-pyridinyl)-1,3-pyrrolidinedicarboxylate

Molecular Formula

C16H21ClN2O4

Molecular Mass

340.80

Cite this Page

rel-1-(1,1-Dimethylethyl) 3-methyl (3R,4R)-4-(4-chloro-3-pyridinyl)-1,3-pyrrolidinedicarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1228666-10-1 (retrieved 2024-09-07) (CAS RN: 1228666-10-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C16H21ClN2O4/c1-16(2,3)23-15(21)19-8-11(12(9-19)14(20)22-4)10-7-18-6-5-13(10)17/h5-7,11-12H,8-9H2,1-4H3/t11-,12-/s2

InChIKey

InChIKey=JBCBYFOBIDCTEV-XXCBQWOANA-N

SMILES

C(OC)(=O)[C@H]1[C@H](CN(C(OC(C)(C)C)=O)C1)C=2C(Cl)=CC=NC2

Canonical SMILES

O=C(OC(C)(C)C)N1CC(C(=O)OC)C(C=2C=NC=CC2Cl)C1

Other Names for this Substance

  • 1,3-Pyrrolidinedicarboxylic acid, 4-(4-chloro-3-pyridinyl)-, 1-(1,1-dimethylethyl) 3-methyl ester, (3R,4R)-rel-
  • rel-1-(1,1-Dimethylethyl) 3-methyl (3R,4R)-4-(4-chloro-3-pyridinyl)-1,3-pyrrolidinedicarboxylate