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Substance Name: Doxepin acetate
RN: 72306-59-3
InChIKey: HSIGUPIIEFHIDN-SJDTYFKWSA-N

Molecular Formula

  • C19-H21-N-O.C2-H4-O2

Molecular Weight

  • 339.4325
 
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Names and Synonyms

Name of Substance

  • Doxepin acetate

Systematic Name

  • 1-Propanamine, 3-dibenz(b,e)oxepin-11(6H)-ylidene-N,N-dimethyl-, acetate

Registry Numbers

CAS Registry Number

  • 72306-59-3

System Generated Number

  • 0072306593

Molecular Formulas

Molecular Formula

  • C19-H21-N-O.C2-H4-O2

Molecular Formula Fragments

  • C19-H21-N-O
  • C2-H4-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C19H21NO.C2H4O2/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19;1-2(3)4/h3-6,8-12H,7,13-14H2,1-2H3;1H3,(H,3,4)/b17-11+;

InChIKey

HSIGUPIIEFHIDN-SJDTYFKWSA-N

Smiles

CN(C)CC\C=C\1/c2ccccc2COc3ccccc13.CC(=O)O