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Substance Name: Bromaleate
RN: 7460-15-3
UNII: QFC5BM98OO
InChIKey: WQDAZEVNOKYARY-TUXKUCLYSA-N

Molecular Weight

  • 1097.8587
 
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Names and Synonyms

Name of Substance

  • Bromaleate

Synonyms

  • 1,2-Ethanediamine, N-((4-methoxyphenyl)methyl)-n',n'-dimethyl-n-2-pyridinyl-, compd. with 2-amino-2-methyl-1-propanol and 8-bromo-3,7-dihydroxy-1,3-dimethyl-1H-purine-2,6-dione (2Z)-2-butenedioate (salt) (1:2:2:1)
  • Neobromth
  • Neoparbrom
  • Neopyrapar
  • Theophylline, 8-bromo-, compd. with 2-amino-2-methyl-1-propanol, 2-((2-(dimethylamino)ethyl)(p-methoxybenzyl)amino)pyridine and maleic acid (2:2:1:1)
  • UNII-QFC5BM98OO

Registry Numbers

CAS Registry Number

  • 7460-15-3

FDA UNII

  • QFC5BM98OO

System Generated Number

  • 0007460153

Structure Descriptors

InChI

1S/C17H23N3O.2C7H7BrN4O2.2C4H11NO.C4H4O4/c1-19(2)12-13-20(17-6-4-5-11-18-17)14-15-7-9-16(21-3)10-8-15;2*1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14;2*1-4(2,5)3-6;5-3(6)1-2-4(7)8/h4-11H,12-14H2,1-3H3;2*1-2H3,(H,9,10);2*6H,3,5H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;;;;;2-1-

InChIKey

WQDAZEVNOKYARY-TUXKUCLYSA-N

Smiles

CC(C)(CO)N.CC(C)(CO)N.Cn1c2c(c(=O)n(c1=O)C)[nH]c(n2)Br.Cn1c2c(c(=O)n(c1=O)C)[nH]c(n2)Br.CN(C)CCN(Cc1ccc(cc1)OC)c2ccccn2.C(=C\C(=O)O)\C(=O)O