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Substance Name: Benzoic acid, 3,3'-(oxybis(ethyleneoxyethylenecarbonylimino))bis(5-(butyramidomethyl)-2,4,6-triiodo-
RN: 51134-97-5
InChIKey: IUBZUALWPQQYOQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C34-H40-I6-N4-O11

Molecular Weight

  • 1442.11
 
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Names and Synonyms

Synonym

  • BRN 2800946

Systematic Name

  • Benzoic acid, 3,3'-(oxybis(ethyleneoxyethylenecarbonylimino))bis(5-(butyramidomethyl)-2,4,6-triiodo-

Registry Numbers

CAS Registry Number

  • 51134-97-5

System Generated Number

  • 0051134975

Structure Descriptors

InChI

1S/C34H40I6N4O11/c1-3-5-19(45)41-15-17-25(35)23(33(49)50)29(39)31(27(17)37)43-21(47)7-9-53-11-13-55-14-12-54-10-8-22(48)44-32-28(38)18(16-42-20(46)6-4-2)26(36)24(30(32)40)34(51)52/h3-16H2,1-2H3,(H,41,45)(H,42,46)(H,43,47)(H,44,48)(H,49,50)(H,51,52)

InChIKey

IUBZUALWPQQYOQ-UHFFFAOYSA-N

Smiles

c1(c(c(c(I)c(c1I)C(O)=O)CNC(CCC)=O)I)NC(CCOCCOCCOCCC(Nc1c(c(c(I)c(c1I)C(O)=O)CNC(CCC)=O)I)=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 6900mg/kg (6900mg/kg)   Farmaco, Edizione Scientifica. Vol. 28, Pg. 912, 1973.