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Substance Name: Indole, 5-acetyl-3-morpholinomethyl-, monohydrate
RN: 69382-21-4
InChIKey: SZVVUHDBXHEZMA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H18-N2-O2.H2-O

Molecular Weight

  • 276.334
 
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Names and Synonyms

Synonym

  • 5-Acetyl-3-morpholinomethylindole monohydrate

Systematic Name

  • Indole, 5-acetyl-3-morpholinomethyl-, monohydrate

Registry Numbers

CAS Registry Number

  • 69382-21-4

System Generated Number

  • 0069382214

Molecular Formulas

Molecular Formula

  • C15-H18-N2-O2.H2-O

Molecular Formula Fragments

  • C15-H18-N2-O2
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C15H18N2O2.H2O/c1-11(18)12-2-3-15-14(8-12)13(9-16-15)10-17-4-6-19-7-5-17;/h2-3,8-9,16H,4-7,10H2,1H3;1H2

InChIKey

SZVVUHDBXHEZMA-UHFFFAOYSA-N

Smiles

c12c(CN3CCOCC3)c[nH]c1ccc(c2)C(C)=O.O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 oral 400mg/kg (400mg/kg) CARDIAC: PULSE RATE INCREASE WITHOUT FALL IN BP

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION

VASCULAR: REGIONAL OR GENERAL ARTERIOLAR OR VENOUS DILATION
Journal of Medicinal Chemistry. Vol. 7, Pg. 141, 1964.