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Substance Name: 1H-Indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-, 2-(2-((4-(benzoylamino)-5-(dipropylamino)-1,5-dioxopentyl)oxy)ethoxy)ethyl ester, (+-)-
RN: 73512-93-3
InChIKey: XLQAWXQZXZOGSE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C41-H48-Cl-N3-O9

Molecular Weight

  • 762.2952
 
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Names and Synonyms

Synonym

  • BRN 0471031

Systematic Name

  • 1H-Indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-, 2-(2-((4-(benzoylamino)-5-(dipropylamino)-1,5-dioxopentyl)oxy)ethoxy)ethyl ester, (+-)-

Registry Numbers

CAS Registry Number

  • 73512-93-3

System Generated Number

  • 0073512933

Structure Descriptors

InChI

1S/C41H48ClN3O9/c1-5-20-44(21-6-2)41(50)35(43-39(48)29-10-8-7-9-11-29)17-19-37(46)53-24-22-52-23-25-54-38(47)27-33-28(3)45(36-18-16-32(51-4)26-34(33)36)40(49)30-12-14-31(42)15-13-30/h7-16,18,26,35H,5-6,17,19-25,27H2,1-4H3,(H,43,48)

InChIKey

XLQAWXQZXZOGSE-UHFFFAOYSA-N

Smiles

CCCN(CCC)C(=O)C(CCC(=O)OCCOCCOC(=O)Cc1c(n(c2c1cc(cc2)OC)C(=O)c3ccc(cc3)Cl)C)NC(=O)c4ccccc4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral > 600mg/kg (600mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 14, Pg. 447, 1979.