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Substance Name: Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo-
RN: 51134-94-2
InChIKey: XAEFFXGVTYPNID-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H20-I6-N2-O8

Molecular Weight

  • 1213.82
 
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Names and Synonyms

Synonyms

  • 3,3'-(Trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodobenzoic acid)
  • BRN 2800019

Systematic Name

  • Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(2,4,6-triiodo-

Registry Numbers

CAS Registry Number

  • 51134-94-2

System Generated Number

  • 0051134942

Structure Descriptors

InChI

1S/C23H20I6N2O8/c24-10-8-12(26)20(18(28)16(10)22(34)35)30-14(32)2-6-38-4-1-5-39-7-3-15(33)31-21-13(27)9-11(25)17(19(21)29)23(36)37/h8-9H,1-7H2,(H,30,32)(H,31,33)(H,34,35)(H,36,37)

InChIKey

XAEFFXGVTYPNID-UHFFFAOYSA-N

Smiles

c1(c(c(c(I)cc1I)C(O)=O)I)NC(CCOCCCOCCC(Nc1c(c(c(I)cc1I)C(O)=O)I)=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 5gm/kg (5000mg/kg)   Farmaco, Edizione Scientifica. Vol. 28, Pg. 912, 1973.