Oseltamivir phosphate

CAS Registry Number®

204255-11-8
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CAS Name

Oseltamivir phosphate

Molecular Formula

C16H28N2O4.H3O4P

Cite this Page

Oseltamivir phosphate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=204255-11-8 (retrieved 2021-09-25) (CAS RN: 204255-11-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H28N2O4.H3O4P/c1-5-12(6-2)22-14-9-11(16(20)21-7-3)8-13(17)15(14)18-10(4)19;1-5(2,3)4/h9,12-15H,5-8,17H2,1-4H3,(H,18,19);(H3,1,2,3,4)/t13-,14+,15+;/m0./s1

InChIKey

InChIKey=PGZUMBJQJWIWGJ-ONAKXNSWSA-N

SMILES

P(=O)(O)(O)O.O(C(CC)CC)[C@H]1[C@H](NC(C)=O)[C@@H](N)CC(C(OCC)=O)=C1

Canonical SMILES

O=C(OCC)C1=CC(OC(CC)CC)C(NC(=O)C)C(N)C1.O=P(O)(O)O

Other Names for this Substance

  • 1-Cyclohexene-1-carboxylic acid, 4-(acetylamino)-5-amino-3-(1-ethylpropoxy)-, ethyl ester, (3R,4R,5S)-, phosphate (1:1)
  • 1-Cyclohexene-1-carboxylic acid, 4-(acetylamino)-5-amino-3-(1-ethylpropoxy)-, ethyl ester, [3R-(3α,4β,5α)]-, phosphate (1:1)
  • Oseltamivir phosphate
  • Ro 64-0796/002
  • Ethyl (3R,4R,5S)-4-N-Acetylamino-5-amino-3-(1-ethylpropoxy)-1-cyclohexene-1-carboxylate phosphate (1:1)

Deleted or Replaced CAS Registry Numbers

332047-25-3