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Substance Name: Ammonium, (5-anilino-9H-benzo(a)phenoxazin-9-ylidene)diethyl-, nitrate
RN: 20816-95-9
InChIKey: XWWDIPHJRKRNRT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H24-N3-O.N-O3

Molecular Weight

  • 456.5
 
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Names and Synonyms

Synonym

  • (5-Anilino-9H-benzo(a)phenoxazin-9-ylidene)diethylammonium, nitrate

Systematic Name

  • Ammonium, (5-anilino-9H-benzo(a)phenoxazin-9-ylidene)diethyl-, nitrate

Registry Numbers

CAS Registry Number

  • 20816-95-9

System Generated Number

  • 0020816959

Molecular Formulas

Molecular Formula

  • C26-H24-N3-O.N-O3

Molecular Formula Fragments

  • C26-H24-N3-O
  • COMPONENT
  • N-O3

Structure Descriptors

InChI

1S/C26H24N3O.NO3/c1-3-29(4-2)19-14-15-22-24(16-19)30-25-17-23(27-18-10-6-5-7-11-18)20-12-8-9-13-21(20)26(25)28-22;2-1(3)4/h5-17,27H,3-4H2,1-2H3;/q+1;-1

InChIKey

XWWDIPHJRKRNRT-UHFFFAOYSA-N

Smiles

c12c3nc4ccc(cc4[o+]c3cc(Nc3ccccc3)c2cccc1)N(CC)CC.[N+]([O-])(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg)   Russian Pharmacology and Toxicology Vol. 32, Pg. 39, 1969.