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Substance Name: Caffeine, sodium benzoate drug combination
RN: 5743-17-9
UNII: C2154V12SE
InChIKey: VXXKVQICUHMECR-UHFFFAOYSA-N

Classification Codes

  • Analgesics
  • Analgesics, Non-Narcotic
  • Antimutagenic Agents
  • Central Nervous System Agents
  • Peripheral Nervous System Agents
  • Protective Agents
  • Sensory System Agents

Molecular Formula

  • C8-H10-N4-O2.C7-H6-O2

Molecular Weight

  • 316.315
 
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Names and Synonyms

Name of Substance

  • Caffeine, sodium benzoate drug combination

Synonyms

  • Caffeine - sodium benzoate
  • Caffeine benzoate
  • EINECS 227-257-3
  • UNII-C2154V12SE

Systematic Name

  • Caffeine benzoate

Registry Numbers

CAS Registry Number

  • 5743-17-9

FDA UNII

  • C2154V12SE

Related Registry Number

  • 8000-95-1 (hydrochloride salt)

System Generated Number

  • 0005743179

Molecular Formulas

Molecular Formula

  • C8-H10-N4-O2.C7-H6-O2

Molecular Formula Fragments

  • C7-H6-O2
  • C8-H10-N4-O2
  • COMPONENT

Structure Descriptors

InChI

InChI=1S/C8H10N4O2.C7H6O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2;8-7(9)6-4-2-1-3-5-6/h4H,1-3H3;1-5H,(H,8,9)

InChIKey

VXXKVQICUHMECR-UHFFFAOYSA-N

Smiles

CN1C(=O)N(C)c2ncn(C)c2C1=O.OC(=O)c3ccccc3