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Substance Name: Hexanoic acid, 6-(5,6-dihydro-11H-pyrido(4,3-c)(1)benzazepin-11-ylidene)-
RN: 127654-09-5
InChIKey: AELBTDZRKWTPMJ-GIDUJCDVSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H20-N2-O2

Molecular Weight

  • 308.379
 
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Names and Synonyms

Synonyms

  • 11-(5-Carboxypentylidene)-11H-5,6-dihydropyrido(4,3-c)(1)benzazepin
  • 6-(5,6-Dihydro-11H-pyrido(4,3-c)(1)benzazepin-11-ylidene)hexanoic acid

Systematic Name

  • Hexanoic acid, 6-(5,6-dihydro-11H-pyrido(4,3-c)(1)benzazepin-11-ylidene)-

Registry Numbers

CAS Registry Number

  • 127654-09-5

System Generated Number

  • 0127654095

Structure Descriptors

InChI

1S/C19H20N2O2/c22-19(23)9-3-1-2-6-15-16-7-4-5-8-18(16)21-12-14-10-11-20-13-17(14)15/h4-8,10-11,13,21H,1-3,9,12H2,(H,22,23)/b15-6+

InChIKey

AELBTDZRKWTPMJ-GIDUJCDVSA-N

Smiles

c1ccc2c(c1)/C(=C\CCCCC(=O)O)/c3cnccc3CN2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 100mg/kg (100mg/kg)   United States Patent Document. Vol. #4971964,
mouse LD oral > 300mg/kg (300mg/kg)   United States Patent Document. Vol. #4971964,