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Substance Name: HME2
RN: 117782-63-5
InChIKey: KYTFTNAVIDOEID-UHFFFAOYSA-N

Molecular Formula

  • C17-H16-Cl2-N4-O5

Molecular Weight

  • 427.2424
 
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Names and Synonyms

Results Name

  • HME2

Name of Substance

  • 7-gamma-(beta-Hydroxypropyl)theophylline 2',4'-dichlorobenzoate

Synonym

  • HME2

Registry Numbers

CAS Registry Number

  • 117782-63-5

System Generated Number

  • 0117782635

Structure Descriptors

InChI

1S/C17H16Cl2N4O5/c1-21-14-13(15(25)22(2)17(21)27)23(8-20-14)6-10(24)7-28-16(26)11-4-3-9(18)5-12(11)19/h3-5,8,10,24H,6-7H2,1-2H3

InChIKey

KYTFTNAVIDOEID-UHFFFAOYSA-N

Smiles

Cn1c2c(c(=O)n(c1=O)C)n(cn2)CC(COC(=O)c3ccc(cc3Cl)Cl)O