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Substance Name: Butanoic acid, 4-((4-methoxyphenyl)(2-((4-methoxyphenyl)(3-(trifluoromethyl)benzoyl)amino)-1-oxopropyl)amino)-
RN: 71455-79-3
InChIKey: WTPSQLNYFAAEEY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H29-F3-N2-O6

Molecular Weight

  • 558.5501
 
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Names and Synonyms

Synonym

  • N-(N-(p-Trifluoromethylbenzoyl)-2-(p-anisidino)propionyl)-4-(p-anisidino)butyric acid

Systematic Name

  • Butanoic acid, 4-((4-methoxyphenyl)(2-((4-methoxyphenyl)(3-(trifluoromethyl)benzoyl)amino)-1-oxopropyl)amino)-

Registry Numbers

CAS Registry Number

  • 71455-79-3

System Generated Number

  • 0071455793

Structure Descriptors

InChI

1S/C29H29F3N2O6/c1-19(27(37)33(17-5-8-26(35)36)22-9-13-24(39-2)14-10-22)34(23-11-15-25(40-3)16-12-23)28(38)20-6-4-7-21(18-20)29(30,31)32/h4,6-7,9-16,18-19H,5,8,17H2,1-3H3,(H,35,36)

InChIKey

WTPSQLNYFAAEEY-UHFFFAOYSA-N

Smiles

CC(C(=O)N(CCCC(=O)O)c1ccc(cc1)OC)N(c2ccc(cc2)OC)C(=O)c3cccc(c3)C(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 130mg/kg (130mg/kg)   United States Patent Document. Vol. #4250183,