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Substance Name: Benzamide, 2-ethoxy-3-methoxy-N-(2-pentylideneaminoethyl)-, oxalate
RN: 63906-78-5
InChIKey: PTYFYNKKKOLUQE-NWBUNABESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H26-N2-O3.C2-H2-O4

Molecular Weight

  • 396.437
 
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Names and Synonyms

Synonym

  • N-(2-Pentylideneaminoethyl)-2-ethoxy-3-methoxybenzamide oxalate

Systematic Name

  • Benzamide, 2-ethoxy-3-methoxy-N-(2-pentylideneaminoethyl)-, oxalate

Registry Numbers

CAS Registry Number

  • 63906-78-5

System Generated Number

  • 0063906785

Molecular Formulas

Molecular Formula

  • C17-H26-N2-O3.C2-H2-O4

Molecular Formula Fragments

  • C17-H26-N2-O3
  • C2-H2-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C17H26N2O3.C2H2O4/c1-4-6-7-11-18-12-13-19-17(20)14-9-8-10-15(21-3)16(14)22-5-2;3-1(4)2(5)6/h8-11H,4-7,12-13H2,1-3H3,(H,19,20);(H,3,4)(H,5,6)/b18-11+;

InChIKey

PTYFYNKKKOLUQE-NWBUNABESA-N

Smiles

c1(c(cccc1OC)C(NCC\[N+]=C\CCCC)=O)OCC.C(C(=O)[O-])(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 45mg/kg (45mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 870, 1969.