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Substance Name: Hexanoic acid, 6-((3,4-dihydro-3,3-dimethyl-1-isoquinolinyl)amino)-
RN: 187884-88-4
InChIKey: OMUPUTZSPUEWKZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H24-N2-O2

Molecular Weight

  • 288.3886
 
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Names and Synonyms

Synonym

  • 6-((3,4-Dihydro-3,3-dimethyl-1-isoquinolinyl)amino)hexanoic acid

Systematic Name

  • Hexanoic acid, 6-((3,4-dihydro-3,3-dimethyl-1-isoquinolinyl)amino)-

Registry Numbers

CAS Registry Number

  • 187884-88-4

System Generated Number

  • 0187884884

Structure Descriptors

InChI

1S/C17H24N2O2/c1-17(2)12-13-8-5-6-9-14(13)16(19-17)18-11-7-3-4-10-15(20)21/h5-6,8-9H,3-4,7,10-12H2,1-2H3,(H,18,19)(H,20,21)

InChIKey

OMUPUTZSPUEWKZ-UHFFFAOYSA-N

Smiles

CC1(Cc2ccccc2C(=N1)NCCCCCC(=O)O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 317mg/kg (317mg/kg)   Pharmaceutical Chemistry Journal Vol. 30, Pg. 675, 1996.