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Substance Name: 1,3-Benzodioxan-2-carboxylic acid, 6-chloro-4-(p-chlorophenyl)-4-methyl-, methyl ester, (E)-
RN: 86616-99-1
InChIKey: GXZSCOQRIDIQTP-DLBZAZTESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H14-Cl2-O4

Molecular Weight

  • 353.1996
 
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Names and Synonyms

Synonyms

  • BRN 5119893
  • RU 26674
  • trans-6-Chloro-4-(p-chlorophenyl)-4-methyl-1,3-benzodioxan-2-carboxylic acid methyl ester

Systematic Name

  • 1,3-Benzodioxan-2-carboxylic acid, 6-chloro-4-(p-chlorophenyl)-4-methyl-, methyl ester, (E)-

Registry Numbers

CAS Registry Number

  • 86616-99-1

System Generated Number

  • 0086616991

Structure Descriptors

InChI

1S/C17H14Cl2O4/c1-17(10-3-5-11(18)6-4-10)13-9-12(19)7-8-14(13)22-16(23-17)15(20)21-2/h3-9,16H,1-2H3/t16-,17+/m0/s1

InChIKey

GXZSCOQRIDIQTP-DLBZAZTESA-N

Smiles

C[C@]1(c2cc(ccc2O[C@@H](O1)C(=O)OC)Cl)c3ccc(cc3)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 18, Pg. 67, 1983.