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Substance Name: Ketone, 3-morpholinomethyl-1,4-benzodioxan-6-yl phenyl, hydrochloride
RN: 100022-13-7
InChIKey: XMDJIURQLSRTIO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-N-O4.Cl-H

Molecular Weight

  • 375.85
 
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Names and Synonyms

Synonyms

  • 1,4-Benzodioxan, 7-benzoyl-2-(morpholinomethyl)-, hydrochloride
  • 3-Morpholinomethyl-1,4-benzodioxan-6-yl phenyl ketone hydrochloride
  • 3633 CT
  • Morpholinomethyl-2 benzoyl-7 benzodioxan chlorhydrate
  • Morpholinomethyl-2 benzoyl-7 benzodioxan chlorhydrate [French]

Systematic Name

  • Ketone, 3-morpholinomethyl-1,4-benzodioxan-6-yl phenyl, hydrochloride

Registry Numbers

CAS Registry Number

  • 100022-13-7

System Generated Number

  • 0100022137

Molecular Formulas

Molecular Formula

  • C20-H21-N-O4.Cl-H

Molecular Formula Fragments

  • C20-H21-N-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H21NO4.ClH/c22-20(15-4-2-1-3-5-15)16-6-7-18-19(12-16)25-17(14-24-18)13-21-8-10-23-11-9-21;/h1-7,12,17H,8-11,13-14H2;1H

InChIKey

XMDJIURQLSRTIO-UHFFFAOYSA-N

Smiles

c12c(ccc(c1)C(c1ccccc1)=O)OC[C@@H](O2)C[NH+]1CCOCC1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 275mg/kg (275mg/kg) BEHAVIORAL: ANALGESIA Therapie. Vol. 13, Pg. 17, 1958.