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Substance Name: Aftobetin Hydrochloride [USAN]
RN: 1353222-83-9
UNII: A1FCZ940WA
InChIKey: GMWHTUNMFTUKHH-NDUABGMUSA-N

Classification Code

  • Early Detection of Alzheimer's Disease

Molecular Formula

  • C26-H32-N2-O5.Cl-H

Molecular Weight

  • 489.0087
 
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Names and Synonyms

Name of Substance

  • Aftobetin Hydrochloride [USAN]

Synonyms

  • 2-Propenoic acid, 2-cyano-3-(6-(1-piperidinyl)-2-naphthalenyl)-, 2-(2-(2-methoxyethoxy)ethoxy)ethyl ester, hydrochloride (1:1), (2E)-
  • Aftobetin Hydrochloride
  • NCE-11
  • UNII-A1FCZ940WA

Systematic Name

  • 2-(2-(2-Methoxyethoxy)ethoxy)ethyl (2E)-2-cyano-3-(6-(piperidin-1-yl)naphthalen-2-yl)prop-2-enoate monohydrochloride

Registry Numbers

CAS Registry Number

  • 1353222-83-9

FDA UNII

  • A1FCZ940WA

System Generated Number

  • 1353222839

Molecular Formulas

Molecular Formula

  • C26-H32-N2-O5.Cl-H

Molecular Formula Fragments

  • C26-H32-N2-O5
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C26H32N2O5.ClH/c1-30-11-12-31-13-14-32-15-16-33-26(29)24(20-27)18-21-5-6-23-19-25(8-7-22(23)17-21)28-9-3-2-4-10-28;/h5-8,17-19H,2-4,9-16H2,1H3;1H/b24-18+;

InChIKey

GMWHTUNMFTUKHH-NDUABGMUSA-N

Smiles

COCCOCCOCCOC(=O)/C(=C/c1ccc2cc(ccc2c1)N3CCCCC3)/C#N.Cl