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Substance Name: Aspirin mixture with chloroquine and prednisolone
RN: 78456-99-2
InChIKey: AJJJNPUIWCOZQN-OJJGEMKLSA-N

Molecular Weight

  • 860.483
 
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Names and Synonyms

Results Name

  • Aspirin mixture with chloroquine and prednisolone

Name of Substance

  • Presocyl

Synonym

  • Aspirin mixture with chloroquine and prednisolone

Systematic Name

  • Pregna-1,4-diene-3,20-dione, 11,17,21-trihydroxy-, (11beta)-, mixt. with 2-(acetyloxy)benzoic acid and N4-(7-chloro-4-quinolinyl)-N1,N1-diethyl-1,4-pentanediamine

Registry Numbers

CAS Registry Number

  • 78456-99-2

System Generated Number

  • 0078456992

Structure Descriptors

InChI

1S/C21H28O5.C18H26ClN3.C9H8O4/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19;1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18;1-6(10)13-8-5-3-2-4-7(8)9(11)12/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3;8-11,13-14H,4-7,12H2,1-3H3,(H,20,21);2-5H,1H3,(H,11,12)/t14-,15-,16-,18+,19-,20-,21-;;/m0../s1

InChIKey

AJJJNPUIWCOZQN-OJJGEMKLSA-N

Smiles

C(CC[C@@H](C)Nc1ccnc2c1ccc(Cl)c2)N(CC)CC.C(=O)(O)c1ccccc1OC(=O)C.C1(C=C[C@@]2([C@H]3[C@H](C[C@@]4([C@](CC[C@@H]4[C@@H]3CCC2=C1)(C(CO)=O)O)C)O)C)=O