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Substance Name: Benzoic acid, p-amino-, 2-(cyclohexylamino)butyl ester, hydrochloride
RN: 69781-66-4
InChIKey: NUBFWNDQODVEDX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H26-N2-O2.Cl-H

Molecular Weight

  • 326.865
 
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Names and Synonyms

Synonym

  • p-Aminobenzoic acid 2-(cyclohexylamino)butyl ester hydrochloride

Systematic Name

  • Benzoic acid, p-amino-, 2-(cyclohexylamino)butyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 69781-66-4

System Generated Number

  • 0069781664

Molecular Formulas

Molecular Formula

  • C17-H26-N2-O2.Cl-H

Molecular Formula Fragments

  • C17-H26-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H26N2O2.ClH/c1-2-15(19-16-6-4-3-5-7-16)12-21-17(20)13-8-10-14(18)11-9-13;/h8-11,15-16,19H,2-7,12,18H2,1H3;1H

InChIKey

NUBFWNDQODVEDX-UHFFFAOYSA-N

Smiles

c1(C(OC[C@@H]([NH2+]C2CCCCC2)CC)=O)ccc(N)cc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 30mg/kg (30mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 90, Pg. 181, 1947.
mouse LD50 subcutaneous 500mg/kg (500mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 90, Pg. 181, 1947.