3,3-Dimethyl 5-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]hexahydro-4,6-dioxo-3H-pyrrolo[3,4-d]isoxazole-3,3-dicarboxylate

CAS Registry Number®

303151-74-8

CAS Name

3,3-Dimethyl 5-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]hexahydro-4,6-dioxo-3H-pyrrolo[3,4-d]isoxazole-3,3-dicarboxylate

Molecular Formula

C17H16ClF3N4O7

Molecular Mass

480.78

Cite this Page

3,3-Dimethyl 5-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]hexahydro-4,6-dioxo-3H-pyrrolo[3,4-d]isoxazole-3,3-dicarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=303151-74-8 (retrieved 2024-11-22) (CAS RN: 303151-74-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H16ClF3N4O7/c1-30-14(28)16(15(29)31-2)9-10(32-24-16)13(27)25(12(9)26)4-3-22-11-8(18)5-7(6-23-11)17(19,20)21/h5-6,9-10,24H,3-4H2,1-2H3,(H,22,23)

InChIKey

InChIKey=TVUGHXCDMSTIQF-UHFFFAOYSA-N

SMILES

C(OC)(=O)C1(C(OC)=O)C2C(ON1)C(=O)N(CCNC3=C(Cl)C=C(C(F)(F)F)C=N3)C2=O

Canonical SMILES

O=C(OC)C1(NOC2C(=O)N(C(=O)C21)CCNC3=NC=C(C=C3Cl)C(F)(F)F)C(=O)OC

Other Names for this Substance

  • 3H-Pyrrolo[3,4-d]isoxazole-3,3-dicarboxylic acid, 5-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]hexahydro-4,6-dioxo-, 3,3-dimethyl ester
  • 2H-Pyrrolo[3,4-d]isoxazole-3,3(3aH)-dicarboxylic acid, 5-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]tetrahydro-4,6-dioxo-, dimethyl ester
  • 3,3-Dimethyl 5-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]hexahydro-4,6-dioxo-3H-pyrrolo[3,4-d]isoxazole-3,3-dicarboxylate

CAS INSIGHTSTM
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