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Substance Name: Benzoic acid, p-amino-, 1-methyl-2-((4-methylcyclohexyl)amino)ethyl ester hydrochloride
RN: 69780-90-1
InChIKey: CDQFABCQCMKYLA-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 1-methyl-2-((4-methylcyclohexyl)amino)ethyl ester hydrochloride

Systematic Name

  • Benzoic acid, p-amino-, 1-methyl-2-((4-methylcyclohexyl)amino)ethyl ester hydrochloride

Registry Numbers

CAS Registry Number

  • 69780-90-1

System Generated Number

  • 0069780901

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/c1-12-3-9-16(10-4-12)19-11-13(2)21-17(20)14-5-7-15(18)8-6-14;/h5-8,12-13,16,19H,3-4,9-11,18H2,1-2H3;1H

InChIKey

CDQFABCQCMKYLA-UHFFFAOYSA-N

Smiles

c1(C(O[C@@H](C[NH2+]C2CCC(C)CC2)C)=O)ccc(N)cc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 175mg/kg (175mg/kg)   Journal of the American Chemical Society. Vol. 66, Pg. 1453, 1944.