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Substance Name: Benzhydrol, alpha-(2-(ethylphenethylamino)-1-methylethyl)-, oxalate (1:1)
RN: 4119-01-1
InChIKey: LNCPOQUOOGYXTR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H31-N-O.C2-H2-O4

Molecular Weight

  • 463.571
 
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Names and Synonyms

Synonyms

  • 1-Propanol, 1,1-diphenyl-3-ethylphenethylamino-2-methyl-, oxalate
  • alpha-(2-(Ethylphenethylamino)-1-methylethyl)benzhydrol oxalate

Systematic Name

  • Benzhydrol, alpha-(2-(ethylphenethylamino)-1-methylethyl)-, oxalate (1:1)

Registry Numbers

CAS Registry Number

  • 4119-01-1

System Generated Number

  • 0004119011

Molecular Formulas

Molecular Formula

  • C26-H31-N-O.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C26-H31-N-O
  • COMPONENT

Structure Descriptors

InChI

1S/C26H31NO.C2H2O4/c1-3-27(20-19-23-13-7-4-8-14-23)21-22(2)26(28,24-15-9-5-10-16-24)25-17-11-6-12-18-25;3-1(4)2(5)6/h4-18,22,28H,3,19-21H2,1-2H3;(H,3,4)(H,5,6)

InChIKey

LNCPOQUOOGYXTR-UHFFFAOYSA-N

Smiles

C([C@@H](C[N@@](CCc1ccccc1)CC)C)(O)(c1ccccc1)c1ccccc1.C(C(=O)O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 oral 1500mg/kg (1500mg/kg) KIDNEY, URETER, AND BLADDER: URINE VOLUME INCREASED

BEHAVIORAL: ANTICONVULSANT
Journal of Medicinal Chemistry. Vol. 8, Pg. 836, 1965.