rel-(2R,3S)-1-([1,1′-Biphenyl]-4-ylcarbonyl)-2,3-piperazinedicarboxylic acid

CAS Registry Number®

263845-86-9
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CAS Name

rel-(2R,3S)-1-([1,1′-Biphenyl]-4-ylcarbonyl)-2,3-piperazinedicarboxylic acid

Molecular Formula

C19H18N2O5

Molecular Mass

354.36

Cite this Page

rel-(2R,3S)-1-([1,1′-Biphenyl]-4-ylcarbonyl)-2,3-piperazinedicarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=263845-86-9 (retrieved 2024-05-13) (CAS RN: 263845-86-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    204-206 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1/C19H18N2O5/c22-17(21-11-10-20-15(18(23)24)16(21)19(25)26)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-9,15-16,20H,10-11H2,(H,23,24)(H,25,26)/t15-,16+/s2

InChIKey

InChIKey=TZKJHTCXJGVDCI-REIYMHPCNA-N

SMILES

C(=O)(N1[C@@H](C(O)=O)[C@@H](C(O)=O)NCC1)C2=CC=C(C=C2)C3=CC=CC=C3

Canonical SMILES

O=C(O)C1NCCN(C(=O)C=2C=CC(=CC2)C=3C=CC=CC3)C1C(=O)O

Other Names for this Substance

  • 2,3-Piperazinedicarboxylic acid, 1-([1,1′-biphenyl]-4-ylcarbonyl)-, (2R,3S)-rel-
  • rel-(2R,3S)-1-([1,1′-Biphenyl]-4-ylcarbonyl)-2,3-piperazinedicarboxylic acid

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