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Substance Name: 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-nitrophenyl)sulfonyl)hydrazide
RN: 114642-64-7
InChIKey: IKBUVISYYKSKJT-VOTSOKGWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H11-N3-O7-S

Molecular Weight

  • 329.288
 
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Names and Synonyms

Synonym

  • Monomethyl (E)-2-butenedioate 2-((4-nitrophenyl)sulfonyl)hydrazide

Systematic Name

  • 2-Butenedioic acid, (E)-, monomethyl ester, 2-((4-nitrophenyl)sulfonyl)hydrazide

Registry Numbers

CAS Registry Number

  • 114642-64-7

System Generated Number

  • 0114642647

Structure Descriptors

InChI

1S/C11H11N3O7S/c1-21-11(16)7-6-10(15)12-13-22(19,20)9-4-2-8(3-5-9)14(17)18/h2-7,13H,1H3,(H,12,15)/b7-6+

InChIKey

IKBUVISYYKSKJT-VOTSOKGWSA-N

Smiles

c1(S(NNC(\C=C\C(OC)=O)=O)(=O)=O)ccc([N+](=O)[O-])cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported 378mg/kg (378mg/kg)   Farmatsevtichnii Zhurnal Vol. (4), Pg. 42, 1987.