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Substance Name: beta-Alanine, N-((5-ethyl-5,8-dihydro-8-oxo-1,3-dioxolo(4,5-g)quinolin-7-yl)carbonyl)-
RN: 104571-64-4
InChIKey: YNEPUNBYKXNTIS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H16-N2-O6

Molecular Weight

  • 332.3104
 
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Names and Synonyms

Synonyms

  • BRN 5629200
  • N-((5-Ethyl-5,8-dihydro-8-oxo-1,3-dioxolo(4,5-g)quinolin-7-yl)carbonyl)-beta-alanine

Systematic Name

  • beta-Alanine, N-((5-ethyl-5,8-dihydro-8-oxo-1,3-dioxolo(4,5-g)quinolin-7-yl)carbonyl)-

Registry Numbers

CAS Registry Number

  • 104571-64-4

System Generated Number

  • 0104571644

Structure Descriptors

InChI

1S/C16H16N2O6/c1-2-18-7-10(16(22)17-4-3-14(19)20)15(21)9-5-12-13(6-11(9)18)24-8-23-12/h5-7H,2-4,8H2,1H3,(H,17,22)(H,19,20)

InChIKey

YNEPUNBYKXNTIS-UHFFFAOYSA-N

Smiles

CCn1cc(c(=O)c2c1cc3c(c2)OCO3)C(=O)NCCC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 500mg/kg (500mg/kg)   Pharmaceutical Chemistry Journal Vol. 21, Pg. 430, 1987.