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Substance Name: Butanoic acid, 4-(((1-(2,6-dichlorophenyl)-1,2-dihydro-2-oxo-3H-indol-3-ylidene)methyl)amino)-, (Z)-
RN: 172371-99-2
InChIKey: WOBFIRAGALWZEP-QBFSEMIESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H16-Cl2-N2-O3

Molecular Weight

  • 391.2524
 
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Names and Synonyms

Synonym

  • (Z)-1-(2',6'-Dichlorophenyl)-3-(gamma-carboxypropyl)aminomethylene-2-indolinone

Systematic Name

  • Butanoic acid, 4-(((1-(2,6-dichlorophenyl)-1,2-dihydro-2-oxo-3H-indol-3-ylidene)methyl)amino)-, (Z)-

Registry Numbers

CAS Registry Number

  • 172371-99-2

System Generated Number

  • 0172371992

Structure Descriptors

InChI

1S/C19H16Cl2N2O3/c20-14-6-3-7-15(21)18(14)23-16-8-2-1-5-12(16)13(19(23)26)11-22-10-4-9-17(24)25/h1-3,5-8,11,22H,4,9-10H2,(H,24,25)/b13-11-

InChIKey

WOBFIRAGALWZEP-QBFSEMIESA-N

Smiles

c1ccc2c(c1)/C(=C/NCCCC(=O)O)/C(=O)N2c3c(cccc3Cl)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported > 1500mg/kg (1500mg/kg)   Pharmaceutical Chemistry Journal Vol. 29, Pg. 100, 1995.