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Substance Name: PX-104
RN: 1268244-88-7
UNII: 378SU5NO8S
InChIKey: XBUXXJUEBFDQHD-NHCUHLMSSA-N

Molecular Formula

  • C29-H22-Cl3-N-O4

Molecular Weight

  • 554.8548
 
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Names and Synonyms

Name of Substance

  • PX-104

Synonyms

  • Benzoic acid, 4-((1R,2R)-2-(2-chloro-4-((5-cyclopropyl-3-(2,6-dichlorophenyl)-4-isoxazolyl)methoxy)phenyl)cyclopropyl)-, rel-(-)-
  • PX-104
  • UNII-378SU5NO8S

Registry Numbers

CAS Registry Number

  • 1268244-88-7

FDA UNII

  • 378SU5NO8S

System Generated Number

  • 1268244887

Structure Descriptors

InChI

1S/C29H22Cl3NO4/c30-23-2-1-3-24(31)26(23)27-22(28(37-33-27)16-6-7-16)14-36-18-10-11-19(25(32)12-18)21-13-20(21)15-4-8-17(9-5-15)29(34)35/h1-5,8-12,16,20-21H,6-7,13-14H2,(H,34,35)/t20-,21-/m1/s1

InChIKey

XBUXXJUEBFDQHD-NHCUHLMSSA-N

Smiles

OC(=O)c1ccc(cc1)[C@H]2C[C@@H]2c3ccc(OCc4c(onc4c5c(Cl)cccc5Cl)C6CC6)cc3Cl