3,5-Diethyl 4-(4-chloro-3-nitrophenyl)-2,6-dihydroxy-2,6-bis(trifluoromethyl)-3,5-piperidinedicarboxylate

CAS Registry Number®

848611-90-5
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CAS Name

3,5-Diethyl 4-(4-chloro-3-nitrophenyl)-2,6-dihydroxy-2,6-bis(trifluoromethyl)-3,5-piperidinedicarboxylate

Molecular Formula

C19H19ClF6N2O8

Molecular Mass

552.81

Cite this Page

3,5-Diethyl 4-(4-chloro-3-nitrophenyl)-2,6-dihydroxy-2,6-bis(trifluoromethyl)-3,5-piperidinedicarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=848611-90-5 (retrieved 2024-08-10) (CAS RN: 848611-90-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C19H19ClF6N2O8/c1-3-35-14(29)12-11(8-5-6-9(20)10(7-8)28(33)34)13(15(30)36-4-2)17(32,19(24,25)26)27-16(12,31)18(21,22)23/h5-7,11-13,27,31-32H,3-4H2,1-2H3

InChIKey

InChIKey=RDMUJVWEBOAMQJ-UHFFFAOYSA-N

SMILES

C(OCC)(=O)C1C(C(C(OCC)=O)C(C(F)(F)F)(O)NC1(C(F)(F)F)O)C2=CC(N(=O)=O)=C(Cl)C=C2

Canonical SMILES

O=C(OCC)C1C(C2=CC=C(Cl)C(=C2)N(=O)=O)C(C(=O)OCC)C(O)(NC1(O)C(F)(F)F)C(F)(F)F

Other Names for this Substance

  • 3,5-Piperidinedicarboxylic acid, 4-(4-chloro-3-nitrophenyl)-2,6-dihydroxy-2,6-bis(trifluoromethyl)-, 3,5-diethyl ester
  • 3,5-Piperidinedicarboxylic acid, 4-(4-chloro-3-nitrophenyl)-2,6-dihydroxy-2,6-bis(trifluoromethyl)-, diethyl ester
  • 3,5-Diethyl 4-(4-chloro-3-nitrophenyl)-2,6-dihydroxy-2,6-bis(trifluoromethyl)-3,5-piperidinedicarboxylate