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Substance Name: Meproadifen mustard
RN: 105555-57-5
InChIKey: KQRMNKAYUSDFBQ-UHFFFAOYSA-N

Molecular Formula

  • C22-H28-Cl-N-O2.Cl-H

Molecular Weight

  • 410.382
 
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Names and Synonyms

Name of Substance

  • Meproadifen mustard

Synonym

  • 2-(Chloroethylmethylamino)ethyl-2,2-diphenylpentanoate hcl

Systematic Name

  • Benzeneacetic acid, alpha-phenyl-alpha-propyl-, 2-((2-chloroethyl)methylamino)ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 105555-57-5

System Generated Number

  • 0105555575

Molecular Formulas

Molecular Formula

  • C22-H28-Cl-N-O2.Cl-H

Molecular Formula Fragments

  • C22-H28-Cl-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H28ClNO2.ClH/c1-3-20(18-9-5-4-6-10-18)21-12-8-7-11-19(21)17-22(25)26-16-15-24(2)14-13-23;/h4-12,20H,3,13-17H2,1-2H3;1H

InChIKey

KQRMNKAYUSDFBQ-UHFFFAOYSA-N

Smiles

c1(c(cccc1)[C@@H](CC)c1ccccc1)CC(=O)OCC[N@@](C)CCCl.Cl