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Substance Name: 2-Propenamide, N-(2-(3,4-dimethoxyphenyl)ethyl)-2-methyl-3-(4-nitrophenyl)-
RN: 76691-31-1
InChIKey: GPHWZTBLBWGAJN-WYMLVPIESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H22-N2-O5

Molecular Weight

  • 370.4028
 
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Names and Synonyms

Synonym

  • N-(2-(3,4-Dimethoxyphenyl)ethyl)-2-methyl-3-(4-nitrophenyl)-2-propenamide

Systematic Name

  • 2-Propenamide, N-(2-(3,4-dimethoxyphenyl)ethyl)-2-methyl-3-(4-nitrophenyl)-

Registry Numbers

CAS Registry Number

  • 76691-31-1

System Generated Number

  • 0076691311

Structure Descriptors

InChI

1S/C20H22N2O5/c1-14(12-15-4-7-17(8-5-15)22(24)25)20(23)21-11-10-16-6-9-18(26-2)19(13-16)27-3/h4-9,12-13H,10-11H2,1-3H3,(H,21,23)/b14-12+

InChIKey

GPHWZTBLBWGAJN-WYMLVPIESA-N

Smiles

C/C(=C\c1ccc(cc1)[N+](=O)[O-])/C(=O)NCCc2ccc(c(c2)OC)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 825mg/kg (825mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 19, Pg. 695, 1980.