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Substance Name: Benzoic acid, 2-((3-(trifluoromethyl)phenyl)amino)-, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester, (+-)-
RN: 55688-39-6
InChIKey: SSVCDEYKPPQRCM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H20-F3-N-O4

Molecular Weight

  • 395.375
 
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Names and Synonyms

Synonym

  • BRN 1269906

Systematic Name

  • Benzoic acid, 2-((3-(trifluoromethyl)phenyl)amino)-, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester, (+-)-

Registry Numbers

CAS Registry Number

  • 55688-39-6

System Generated Number

  • 0055688396

Structure Descriptors

InChI

1S/C20H20F3NO4/c1-19(2)27-12-15(28-19)11-26-18(25)16-8-3-4-9-17(16)24-14-7-5-6-13(10-14)20(21,22)23/h3-10,15,24H,11-12H2,1-2H3

InChIKey

SSVCDEYKPPQRCM-UHFFFAOYSA-N

Smiles

CC1(OCC(O1)COC(=O)c2ccccc2Nc3cccc(c3)C(F)(F)F)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Farmaco, Edizione Scientifica. Vol. 30, Pg. 276, 1975.