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Substance Name: 2-Buten-1-one, 3-amino-1-(2-phenyl-1H-indol-3-yl)-
RN: 62367-93-5
InChIKey: UIOXYFATQNTMAT-QXMHVHEDSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H16-N2-O

Molecular Weight

  • 276.3374
 
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Names and Synonyms

Synonyms

  • 3-Amino-1-(2-phenyl-1H-indol-3-yl)-2-buten-1-one
  • 5-22-13-00180 (Beilstein Handbook Reference)
  • BRN 0410846
  • Phenyl-2 (amino-3' crotonyl)-3 indole
  • Phenyl-2 (amino-3' crotonyl)-3 indole [French]

Systematic Name

  • 2-Buten-1-one, 3-amino-1-(2-phenyl-1H-indol-3-yl)-

Registry Numbers

CAS Registry Number

  • 62367-93-5

System Generated Number

  • 0062367935

Structure Descriptors

InChI

1S/C18H16N2O/c1-12(19)11-16(21)17-14-9-5-6-10-15(14)20-18(17)13-7-3-2-4-8-13/h2-11,20H,19H2,1H3/b12-11-

InChIKey

UIOXYFATQNTMAT-QXMHVHEDSA-N

Smiles

C/C(=C/C(=O)c1c2ccccc2[nH]c1c3ccccc3)/N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 500mg/kg (500mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 11, Pg. 471, 1976.