1,1-Dimethylethyl 3-(4-fluorophenyl)-3a,4,6,6a-tetrahydro-6a-(1-pyrrolidinyl)-5H-pyrrolo[3,4-d]isoxazole-5-carboxylate

CAS Registry Number®

1421311-99-0
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CAS Name

1,1-Dimethylethyl 3-(4-fluorophenyl)-3a,4,6,6a-tetrahydro-6a-(1-pyrrolidinyl)-5H-pyrrolo[3,4-d]isoxazole-5-carboxylate

Molecular Formula

C20H26FN3O3

Molecular Mass

375.44

Cite this Page

1,1-Dimethylethyl 3-(4-fluorophenyl)-3a,4,6,6a-tetrahydro-6a-(1-pyrrolidinyl)-5H-pyrrolo[3,4-d]isoxazole-5-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1421311-99-0 (retrieved 2024-08-13) (CAS RN: 1421311-99-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H26FN3O3/c1-19(2,3)26-18(25)23-12-16-17(14-6-8-15(21)9-7-14)22-27-20(16,13-23)24-10-4-5-11-24/h6-9,16H,4-5,10-13H2,1-3H3

InChIKey

InChIKey=VBCGEVBVHXADNX-UHFFFAOYSA-N

SMILES

C(OC(C)(C)C)(=O)N1CC2(C(C(=NO2)C3=CC=C(F)C=C3)C1)N4CCCC4

Canonical SMILES

O=C(OC(C)(C)C)N1CC2C(=NOC2(N3CCCC3)C1)C=4C=CC(F)=CC4

Other Names for this Substance

  • 5H-Pyrrolo[3,4-d]isoxazole-5-carboxylic acid, 3-(4-fluorophenyl)-3a,4,6,6a-tetrahydro-6a-(1-pyrrolidinyl)-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 3-(4-fluorophenyl)-3a,4,6,6a-tetrahydro-6a-(1-pyrrolidinyl)-5H-pyrrolo[3,4-d]isoxazole-5-carboxylate