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Substance Name: Benzoic acid, 3,5-dinitro-, (1-((bis(2-hydroxyethyl)amino)methyl)-5-chloro-1,2-dihydro-2-oxo-3H-indol-3-ylidene)hydrazide
RN: 100757-13-9
InChIKey: JJGIEMZOIIIAQD-RELWKKBWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H19-Cl-N6-O8

Molecular Weight

  • 506.8571
 
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Names and Synonyms

  • Benzoic acid, 3,5-dinitro-, (1-((bis(2-hydroxyethyl)amino)methyl)-5-chloro-1,2-dihydro-2-oxo-3H-indol-3-ylidene)hydrazide

Registry Numbers

CAS Registry Number

  • 100757-13-9

System Generated Number

  • 0100757139

Structure Descriptors

InChI

1S/C20H19ClN6O8/c21-13-1-2-17-16(9-13)18(20(31)25(17)11-24(3-5-28)4-6-29)22-23-19(30)12-7-14(26(32)33)10-15(8-12)27(34)35/h1-2,7-10,28-29H,3-6,11H2,(H,23,30)/b22-18+

InChIKey

JJGIEMZOIIIAQD-RELWKKBWSA-N

Smiles

c1cc2c(cc1Cl)/C(=N\NC(=O)c3cc(cc(c3)[N+](=O)[O-])[N+](=O)[O-])/C(=O)N2CN(CCO)CCO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Indian Drugs. Vol. 22, Pg. 302, 1985.