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Substance Name: Carbanilic acid, diester with (2-ethoxy-3-methoxyphenethyl)iminodiethanol, hydrochloride
RN: 27467-06-7
InChIKey: XNTKAUVCFYTMQO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H35-N3-O6.Cl-H

Molecular Weight

  • 558.071
 
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Names and Synonyms

Synonym

  • Ethanol, 2,2'-(2-ethoxy-3-methoxyphenethyl)iminodi-, dicarbanilate, hydrochloride

Systematic Name

  • Carbanilic acid, diester with (2-ethoxy-3-methoxyphenethyl)iminodiethanol, hydrochloride

Registry Numbers

CAS Registry Number

  • 27467-06-7

System Generated Number

  • 0027467067

Molecular Formulas

Molecular Formula

  • C29-H35-N3-O6.Cl-H

Molecular Formula Fragments

  • C29-H35-N3-O6
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C29H35N3O6.ClH/c1-3-36-27-23(11-10-16-26(27)35-2)17-18-32(19-21-37-28(33)30-24-12-6-4-7-13-24)20-22-38-29(34)31-25-14-8-5-9-15-25;/h4-16H,3,17-22H2,1-2H3,(H,30,33)(H,31,34);1H

InChIKey

XNTKAUVCFYTMQO-UHFFFAOYSA-N

Smiles

c1(c(CC[NH+](CCOC(Nc2ccccc2)=O)CCOC(Nc2ccccc2)=O)cccc1OC)OCC.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 100mg/kg (100mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 648, 1970.