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Substance Name: Embraminteoclat
RN: 21661-63-2
UNII: C0E85T23QR
InChIKey: UZJKOLCOUILXEJ-UHFFFAOYSA-N

Note

  • Contains embramine & theophylline.

Molecular Formula

  • C18-H22-Br-N-O.C7-H7-Cl-N4-O2

Molecular Weight

  • 562.893
 
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Names and Synonyms

Name of Substance

  • Embraminteoclat

Synonyms

  • Mebrophenhydramine chlorotheophyllinate
  • Mebrophenhydrinate
  • Medrin
  • UNII-C0E85T23QR

Systematic Names

  • 1H-Purine-2,6-dione, 8-chloro-3,7-dihydro-1,3-dimethyl-, compd. with 2-(1-(4-bromophenyl)-1-phenylethoxy)-N,N-dimethylethanamine (1:1)
  • 2-(p-Bromo-alpha-methyl-alpha-phenylbenzyloxy)-N,N-dimethylethylamine cpd with 8-chloro theophylline
  • Ethanamine, 2-(1-(4-bromophenyl)-1-phenylethoxy)-N,N-dimethyl-, compd. with 8-chloro-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (1:1)
  • Ethylamine, 2-((p-bromo-alpha-methyl-alpha-phenylbenzyl)oxy)-N,N-dimethyl-, compd. with 8-chlorotheophylline (1:1)
  • Theophylline, 8-chloro-, compd. with 2-((p-bromo-alpha-methyl-alpha-phenylbenzyl)oxy)-N,N-dimethylethylamine (1:1)

Registry Numbers

CAS Registry Number

  • 21661-63-2

FDA UNII

  • C0E85T23QR

Other Registry Number

  • 25454-97-1

System Generated Number

  • 0021661632

Molecular Formulas

Molecular Formula

  • C18-H22-Br-N-O.C7-H7-Cl-N4-O2

Molecular Formula Fragments

  • C18-H22-Br-N-O
  • C7-H7-Cl-N4-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C18H22BrNO.C7H7ClN4O2/c1-18(21-14-13-20(2)3,15-7-5-4-6-8-15)16-9-11-17(19)12-10-16;1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14/h4-12H,13-14H2,1-3H3;1-2H3,(H,9,10)

InChIKey

UZJKOLCOUILXEJ-UHFFFAOYSA-N

Smiles

c12n(c(n(c(c1[nH]c(n2)Cl)=O)C)=O)C.C(CO[C@@](C)(c1ccc(cc1)Br)c1ccccc1)N(C)C