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Substance Name: 2-Propenoic acid, 3-(3-(3-(4-chlorophenyl)-1-oxo-2-propenyl)phenyl)-, ethyl ester, (E,E)-
RN: 82885-71-0
InChIKey: MPMYNCUDKKYWRG-QHKWOANTSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H17-Cl-O3

Molecular Weight

  • 340.8043
 
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Names and Synonyms

Synonym

  • Ethyl (E,E)-3-(3-(3-(4-chlorophenyl)-1-oxo-2-propenyl)phenyl)-2-propenoate

Systematic Name

  • 2-Propenoic acid, 3-(3-(3-(4-chlorophenyl)-1-oxo-2-propenyl)phenyl)-, ethyl ester, (E,E)-

Registry Numbers

CAS Registry Number

  • 82885-71-0

System Generated Number

  • 0082885710

Structure Descriptors

InChI

1S/C20H17ClO3/c1-2-24-20(23)13-9-16-4-3-5-17(14-16)19(22)12-8-15-6-10-18(21)11-7-15/h3-14H,2H2,1H3/b12-8+,13-9+

InChIKey

MPMYNCUDKKYWRG-QHKWOANTSA-N

Smiles

CCOC(=O)/C=C/c1cccc(c1)C(=O)/C=C/c2ccc(cc2)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 1600mg/kg (1600mg/kg)   United States Patent Document. Vol. #4421927,