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Substance Name: Oxpoconazole fumarate [ISO]
RN: 174212-12-5
InChIKey: IKNXXTIMVROREQ-WXXKFALUSA-N

Molecular Formula

  • C42-H52-Cl2-N6-O8

Molecular Weight

  • 839.8128
 
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Names and Synonyms

Name of Substance

  • Oxpoconazole fumarate [ISO]

Synonym

  • Oxpoconazole fumarate

Registry Numbers

CAS Registry Number

  • 174212-12-5

System Generated Number

  • 0174212125

Structure Descriptors

InChI

1S/2C19H24ClN3O2.C4H4O4/c2*1-18(2)13-25-19(3,23(18)17(24)22-12-11-21-14-22)10-4-5-15-6-8-16(20)9-7-15;5-3(6)1-2-4(7)8/h2*6-9,11-12,14H,4-5,10,13H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;;2-1+

InChIKey

IKNXXTIMVROREQ-WXXKFALUSA-N

Smiles

n1(ccnc1)C(N1C(CO[C@@]1(CCCc1ccc(cc1)Cl)C)(C)C)=O.n1(ccnc1)C(N1C(CO[C@@]1(CCCc1ccc(cc1)Cl)C)(C)C)=O.C(\C=C\C(=O)O)(=O)O